Results for:
Species: Cytophaga-Flavobacterium-Bacteroides (CFB)

Signature

Dodecan-2-one

Mass-Spectra

Compound Details

Synonymous names	2-Dodecanone Dodecan-2-one 6175-49-1 Decyl methyl ketone METHYL DECYL KETONE Dodecanone-(2) MFCD00015064 P5CN8YSV3P CHEBI:89284 EINECS 228-222-5 UNII-P5CN8YSV3P n-DECYL METHYL KETONE AI3-28136 2-Dodecanone, 95% SCHEMBL103221 CHEMBL2228472 DTXSID4022236 2-Dodecanone, >=97.0% (GC) LMFA12000163 AKOS009158766 MCULE-3936750617 NCGC00166062-01 AS-14475 2-Dodecanone, analytical reference material CS-0314654 D1862 NS00022516 D89937 A833406 Q27161470
Microorganism:	Yes
IUPAC name	dodecan-2-one
SMILES	CCCCCCCCCCC(=O)C
Inchi	InChI=1S/C12H24O/c1-3-4-5-6-7-8-9-10-11-12(2)13/h3-11H2,1-2H3
Formula	C12H24O
PubChem ID	22556
Molweight	184.32
LogP	4.6
Atoms	13
Bonds	9
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	aliphatic ketones ketones
CHEBI-ID	89284
Supernatural-ID	SN0214124

mVOC Specific Details

Boiling Point	Degree Reference 245 median
MS-Links	MS-MS Spectrum 15010 MS-MS Spectrum 8338 MS-MS Spectrum 8336 MS-MS Spectrum 8337 MS-MS Spectrum 15009 MS-MS Spectrum 15008
1D-NMR-Links	1D NMR Spectrum 4209 1D NMR Spectrum 3930
Massbank-Links	Massbank Spectrum MSBNK-Fac_Eng_Univ_Tokyo-JP007052

Species emitting the compound

Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Escherichia Coli NA NA Fitzgerald et al. 2021 Prokaryota Escherichia Coli NA NA Hewett et al. 2020 Prokaryota Pseudomonas Aeruginosa NA NA Bean et al. 2012 Prokaryota Pseudomonas Aeruginosa NA NA Davis et al. 2020 Prokaryota Bacillus Sp. antifungal activity against Fusarium solani Rhizosphere soil of avocado Guevara-Avendaño et al. 2019 Prokaryota Bacillus Amyloliquefaciens Inhibition of fusarium oxysporum f.sp. Niveum rhizosphere soils of watermelon plants Wu et al. 2019 Prokaryota Pseudomonas Sp. antifungal activity against Thielaviopsis ethacetica mycelial growth Brazilian Biorenewables National Laboratory – LNBR/CNPEM Microorganism Collection, Campinas, SP; isolatedfrom soil and roots of highly productive sugarcane-producing regions; Brazil Freitas et al. 2022 Prokaryota Staphylococcus Epidermidis American Type Culture Collection Jenkins and Bean 2020 Prokaryota Burkholderia Ambifaria NA Groenhagen et al. 2013 Prokaryota Serratia Plymuthica n/a NA Weise et al. 2014 Prokaryota Serratia Proteamaculans n/a NA Weise et al. 2014 Prokaryota Serratia Marcescens n/a NA Weise et al. 2014 Prokaryota Serratia Sp. n/a NA Bruce et al. 2004 Prokaryota Serratia Sp. n/a NA Schulz and Dickschat 2007 Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a NA Schulz and Dickschat 2007 Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a NA Dickschat et al. 2005_3 Prokaryota Xanthomonas Campestris n/a NA Weise et al. 2012 Prokaryota Achromobacter Sp. NA NA Almeida et al. 2022 Prokaryota Enterobacter Sp. NA NA Almeida et al. 2022 Prokaryota Bacillus Velezensis NA NA Toral et al. 2021

Method

Kingdom Species Growth Medium Applied Method Verification Prokaryota Escherichia Coli TSB SPME/GC-MS no Prokaryota Escherichia Coli LB SPME/GC-MS no Prokaryota Pseudomonas Aeruginosa lysogeny broth SPME/GCxGC-MS no Prokaryota Pseudomonas Aeruginosa LB broth SPME/GCxGC-MS no Prokaryota Bacillus Sp. LB agar SPME-GC-MS no Prokaryota Bacillus Amyloliquefaciens modified Murashige-Skoog (MS) culture medium SPME-GC-MS no Prokaryota Pseudomonas Sp. LB media, DYGS media HS-SPME/GC-MS no Prokaryota Pseudomonas Sp. LB media HS-SPME/GC-MS no Prokaryota Staphylococcus Epidermidis BHI media, MHB media HS-SPME/GC×GC-TOFMS no Prokaryota Burkholderia Ambifaria Luria-Bertani medium, Malt Extract yes Prokaryota Serratia Plymuthica NBII Headspace trapping/ GC-MS no Prokaryota Serratia Proteamaculans NBII Headspace trapping/ GC-MS no Prokaryota Serratia Marcescens NBII Headspace trapping/ GC-MS no Prokaryota Serratia Sp. n/a n/a no Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a n/a no Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a n/a no Prokaryota Xanthomonas Campestris NBII Closed airflow-system/GC-MS and PTR-MS no Prokaryota Achromobacter Sp. LB broth supplemented with cryoprotectant solution (25 g L−1 gelatin, 50 g L−1 lactose, 10 g L−1 peptone, and 250 g L−1 glycerol) SPME with gas chromatograph (Agilent 7890A, Agilent Technologies) connected to a mass spectrometer (Pegasus® HT TOFMS, LECO Corporation) no Prokaryota Enterobacter Sp. LB broth supplemented with cryoprotectant solution (25 g L−1 gelatin, 50 g L−1 lactose, 10 g L−1 peptone, and 250 g L−1 glycerol) SPME with gas chromatograph (Agilent 7890A, Agilent Technologies) connected to a mass spectrometer (Pegasus® HT TOFMS, LECO Corporation) no Prokaryota Bacillus Velezensis tryptic soy agar (TSA, Panreac Applichem) medium HS-SPME-GC/MS no

(2S)-13-methyltetradecan-2-ol

Compound Details

Synonymous names	(S)-13-Methyltetradecan-2-ol (2S)-13-methyltetradecan-2-ol CHEBI:198615
Microorganism:	Yes
IUPAC name	(2S)-13-methyltetradecan-2-ol
SMILES	CC(C)CCCCCCCCCCC(C)O
Inchi	InChI=1S/C15H32O/c1-14(2)12-10-8-6-4-5-7-9-11-13-15(3)16/h14-16H,4-13H2,1-3H3/t15-/m0/s1
Formula	C15H32O
PubChem ID	139583432
Molweight	228.41
LogP	6.4
Atoms	16
Bonds	11
H-bond Acceptor	1
H-bond Donor	1
Chemical Classification	alcohols
CHEBI-ID	198615
Supernatural-ID	SN0420234-01

mVOC Specific Details

Species emitting the compound	Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a NA Schulz and Dickschat 2007 Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a NA Dickschat et al. 2005_3
Method	Kingdom Species Growth Medium Applied Method Verification Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a n/a no Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a n/a no

Tridecan-2-one

Mass-Spectra

Compound Details

Synonymous names	2-TRIDECANONE Tridecan-2-one 593-08-8 Methyl undecyl ketone Mathyl undecyl kepoje Hendecyl methyl ketone 2-Tridecankje Tridecanone-2 Methyl n-undecyl ketone TRIDECANONE FEMA No. 3388 NSC 14763 MFCD00008968 5Q35VHX26K DTXSID4022070 CHEBI:77928 NSC-14763 2-Tridecanone (natural) EINECS 209-784-0 UNII-5Q35VHX26K AI3-04238 2-Tridecanone, 99% 2-TRIDECANONE [FCC] n-BUTYL-n-OCTYL KETONE 2-TRIDECANONE [FHFI] SCHEMBL119126 CHEMBL480097 DTXCID302070 2-Tridecanone, >=96%, FG FEMA 3388 2-Tridecanone, analytical standard NSC14763 Tox21_301838 LMFA12000058 AKOS009158653 2-Tridecanone, >=98%, natural, FG CS-W010527 HY-W009811 Dimethoxy methyldopa hydrochloride(DMMD) NCGC00255260-01 CAS-593-08-8 PD158263 2-Tridecanone, purum, >=97.0% (GC) DB-003333 NS00013250 T0415 D78019 A832256 W-105331 Q27147536 2TD
Microorganism:	Yes
IUPAC name	tridecan-2-one
SMILES	CCCCCCCCCCCC(=O)C
Inchi	InChI=1S/C13H26O/c1-3-4-5-6-7-8-9-10-11-12-13(2)14/h3-12H2,1-2H3
Formula	C13H26O
PubChem ID	11622
Molweight	198.34
LogP	5.2
Atoms	14
Bonds	10
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	ketones
CHEBI-ID	77928
Supernatural-ID	SN0058887

mVOC Specific Details

Boiling Point	Degree Reference 134 median
MS-Links	MS-MS Spectrum 69255 MS-MS Spectrum 69257 MS-MS Spectrum 69256 MS-MS Spectrum 127489 MS-MS Spectrum 127488 MS-MS Spectrum 127490
Massbank-Links	Massbank Spectrum MSBNK-Fac_Eng_Univ_Tokyo-JP007053

Species emitting the compound

Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Escherichia Coli NA NA Fitzgerald et al. 2021 Prokaryota Pseudomonas Aeruginosa NA NA Bean et al. 2012 Eukaryota Aspergillus Fumigatus NA NA Neerincx et al. 2016 Prokaryota Escherichia Coli NA NA Devaraj et al. 2018 Prokaryota Escherichia Coli NA NA Dixon et al. 2022 Prokaryota Lactobacillus Plantarum NA Yang et al. 2022 Prokaryota Corynebacterium Minutissimum clinical isolate,trunk of adult female Lemfack et al. 2016 Prokaryota Bacillus Sp. KX395632.1 Fincheira et al. 2017 Prokaryota Sinorhizobium Meliloti surface-associated NA López-Lara et al. 2018 Prokaryota Staphylococcus Epidermidis NA Timm et al. 2018 Prokaryota Shigella Sonnei China Center of Industrial Culture collection Wang et al. 2018 Prokaryota Vibrio Parahaemolyticus China Center of Industrial Culture collection Wang et al. 2018 Prokaryota Bacillus Sp. antifungal activity against Fusarium solani Rhizosphere soil of avocado Guevara-Avendaño et al. 2019 Prokaryota Bacillus Amyloliquefaciens Inhibition of fusarium oxysporum f.sp. Niveum rhizosphere soils of watermelon plants Wu et al. 2019 Prokaryota Pseudomonas Sp. antifungal activity against Thielaviopsis ethacetica mycelial growth Brazilian Biorenewables National Laboratory – LNBR/CNPEM Microorganism Collection, Campinas, SP; isolatedfrom soil and roots of highly productive sugarcane-producing regions; Brazil Freitas et al. 2022 Prokaryota Bacillus Mycoides stimulate growth of Solanum tuberosum isolate from Irish potato soils Heenan-Daly et al. 2021 Prokaryota Serratia Fonticola stimulate growth of Solanum tuberosum isolate from Irish potato soils Heenan-Daly et al. 2021 Eukaryota Candida Albicans ATCC MYA-2876, American Type Culture Collection Costa et al. 2020 Eukaryota Candida Glabrata ATCC 90030, American Type Culture Collection Costa et al. 2020 Eukaryota Candida Tropicalis ATCC 750, American Type Culture Collection Costa et al. 2020 Prokaryota Escherichia Coli Leibnitz Institute DSMZ-German Collection of Microorganisms and Cell Cultures GmbH Fitzgerald et al. 2020 Prokaryota Microbacterium Paraoxydans antifungal effect on the growth of Alternaria alternata, Corynespora cassiicola and Stemphylium lycopersici (pathogens of tomato plants) leaves of tomato plants (Elpida F1, Enza Zaden) with symptoms of Gray leaf spot López et al. 2021 Prokaryota Bacillus Sp. antifungal effect on the growth of Alternaria alternata, Corynespora cassiicola and Stemphylium lycopersici (pathogens of tomato plants) NA López et al. 2021 Prokaryota Staphylococcus Aureus American Type Culture Collection Jenkins and Bean 2020 Prokaryota Escherichia Coli Swedish Institute for Communicable Disease Control (SMI), Stockholm, Sweden Sousa et al. 2023 Prokaryota Pseudomonas Fluorescens n/a NA Fernando et al. 2005 Prokaryota Pseudomonas Corrugata n/a NA Fernando et al. 2005 Prokaryota Pseudomonas Chlororaphis n/a NA Fernando et al. 2005 Prokaryota Pseudomonas Aurantiaca n/a NA Fernando et al. 2005 Prokaryota Plectonema Notatum n/a NA Hoeckelmann et al. 2004 Prokaryota Phormidium Sp. n/a NA Hoeckelmann et al. 2004 Prokaryota Rivularia Sp. n/a NA Hoeckelmann et al. 2004 Prokaryota Calothrix Parietina n/a NA Hoeckelmann et al. 2004 Prokaryota Serratia Plymuthica n/a NA Weise et al. 2014 Prokaryota Serratia Proteamaculans n/a NA Weise et al. 2014 Prokaryota Serratia Marcescens n/a NA Weise et al. 2014 Prokaryota Serratia Odorifera n/a NA Weise et al. 2014 Prokaryota Burkholderia Ambifaria n/a Burkholderia ambifaria LMG 17828 from root, LMG 19182 from rhizosphere Groenhagen et al. 2013 Prokaryota Burkholderia Andropogonis n/a NA Blom et al. 2011 Prokaryota Bacillus Cereus n/a NA Blom et al. 2011 Prokaryota Burkholderia Anthina n/a NA Blom et al. 2011 Prokaryota Burkholderia Caledonica n/a NA Blom et al. 2011 Prokaryota Burkholderia Fungorum n/a NA Blom et al. 2011 Prokaryota Burkholderia Glathei n/a NA Blom et al. 2011 Prokaryota Burkholderia Graminis n/a NA Blom et al. 2011 Prokaryota Burkholderia Lata n/a NA Blom et al. 2011 Prokaryota Burkholderia Phenoliruptrix n/a NA Blom et al. 2011 Prokaryota Escherichia Coli n/a NA Blom et al. 2011 Prokaryota Serratia Marcescens n/a NA Blom et al. 2011 Prokaryota Serratia Plymuthica n/a NA Blom et al. 2011 Prokaryota Klebsiella Pneumoniae n/a NA Elgaali et al. 2002 Prokaryota Escherichia Coli National collection of type cultures (NCTC) UK Tait et al. 2014 Prokaryota Citrobacter Freundii American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology Laboratory Elgaali et al. 2002 Prokaryota Enterobacter Aerogenes American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology Laboratory Elgaali et al. 2002 Prokaryota Enterobacter Cloacae American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology Laboratory Elgaali et al. 2002 Prokaryota Escherichia Coli American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology Laboratory Elgaali et al. 2002 Prokaryota Salmonella Paratyphi American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology Laboratory Elgaali et al. 2002 Prokaryota Shigella Sonnei American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology Laboratory Elgaali et al. 2002 Prokaryota Enterococcus Durans American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology Laboratory Elgaali et al. 2002 Prokaryota Enterococcus Faecium American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology Laboratory Elgaali et al. 2002 Prokaryota Lactobacillus Lactis American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology Laboratory Elgaali et al. 2002 Prokaryota Leuconostoc Mesenteroides American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology Laboratory Elgaali et al. 2002 Prokaryota Streptococcus Thermophilus American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology Laboratory Elgaali et al. 2002 Prokaryota Pseudomonas Brassicacearum na rhizosphere of bean plants, southern Italy Giorgio et al. 2015 Prokaryota Pseudomonas Putida na rhizosphere of bean plants, southern Italy Giorgio et al. 2015 Prokaryota Bacillus Subtilis triggers induced systemic resistance (ISR) in Arabidopsis na Ryu et al. 2004 Prokaryota Bacillus Amyloliquefaciens triggers induced systemic resistance (ISR) in Arabidopsis na Ryu et al. 2004 Eukaryota Pleurotus Cystidiosus na na Usami et al. 2014 Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a NA Schulz and Dickschat 2007 Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a NA Dickschat et al. 2005_3 Prokaryota Xanthomonas Campestris n/a NA Weise et al. 2012 Prokaryota Pseudochrobactrum Saccharolyticum Nematicidal activity cow dung XU et al. 2015 Prokaryota Wautersiella Falsenii Nematicidal activity cow dung XU et al. 2015 Prokaryota Achromobacter Sp. NA NA Almeida et al. 2022 Prokaryota Serratia Sp. NA NA Almeida et al. 2022 Prokaryota Enterobacter Sp. NA NA Almeida et al. 2022 Prokaryota Bacillus Velezensis NA NA Toral et al. 2021 Prokaryota Lactobacillus Plantarum NA NA Zhang et al. 2022 Lactobacillus Plantarum Ma et al. 2023

Method

Kingdom Species Growth Medium Applied Method Verification Prokaryota Escherichia Coli BHI SPME/GC-MS no Prokaryota Escherichia Coli TSB SPME/GC-MS no Prokaryota Escherichia Coli LB SPME/GC-MS no Prokaryota Pseudomonas Aeruginosa lysogeny broth SPME/GCxGC-MS no Eukaryota Aspergillus Fumigatus SDB + chloramphenicol TD/GC-MS no Prokaryota Escherichia Coli TSA TD/GC-MS no Prokaryota Escherichia Coli LB TD/GC-MS no Prokaryota Lactobacillus Plantarum ginkgo biloba kernel juice triple quadrupole GC-MS no Prokaryota Corynebacterium Minutissimum brain heart infusion medium Porapak / GC/MS no Prokaryota Bacillus Sp. Plate Count agar (PCA) GC–MS yes Prokaryota Bacillus Sp. Methyl Red & Voges Proskauer broth (MRVP-B) SPME, GC-MS yes Prokaryota Sinorhizobium Meliloti tryptone yeast (TY) SPME, GC-MS yes Prokaryota Staphylococcus Epidermidis TSA SPME, GC-MS no Prokaryota Shigella Sonnei Sodium chloride broth SPME, GC-MS no Prokaryota Vibrio Parahaemolyticus Sodium chloride broth SPME, GC-MS no Prokaryota Bacillus Sp. LB agar SPME-GC-MS no Prokaryota Bacillus Amyloliquefaciens modified Murashige-Skoog (MS) culture medium SPME-GC-MS no Prokaryota Pseudomonas Sp. LB media, DYGS media HS-SPME/GC-MS yes Prokaryota Bacillus Mycoides TSB media, M+S (Murashige and Skoog) media SPME/GC-MS no Prokaryota Serratia Fonticola TSB media, MR-VP (Methyl Red-Vogos Proskeur) media, M+S (Murashige and Skoog) media SPME/GC-MS no Eukaryota Candida Albicans YGC media HS-SPME/GC-GC-ToFMS no Eukaryota Candida Glabrata YGC media HS-SPME/GC-GC-ToFMS no Eukaryota Candida Tropicalis YGC media HS-SPME/GC-GC-ToFMS no Prokaryota Escherichia Coli TSB media HS-SPME/GC-MS no Prokaryota Microbacterium Paraoxydans TYB media GC-MS no Prokaryota Bacillus Sp. TYB media GC-MS no Prokaryota Staphylococcus Aureus BHI media, LB media, MHB media, TSB media HS-SPME/GC×GC-TOFMS no Prokaryota Escherichia Coli LB media, rocket lysate, spinach lysate HS-SPME/GC-MS no Prokaryota Pseudomonas Fluorescens n/a n/a no Prokaryota Pseudomonas Corrugata n/a n/a no Prokaryota Pseudomonas Chlororaphis n/a n/a no Prokaryota Pseudomonas Aurantiaca n/a n/a no Prokaryota Plectonema Notatum n/a n/a no Prokaryota Phormidium Sp. n/a n/a no Prokaryota Rivularia Sp. n/a n/a no Prokaryota Calothrix Parietina n/a n/a no Prokaryota Serratia Plymuthica NBII Headspace trapping/ GC-MS no Prokaryota Serratia Proteamaculans NBII Headspace trapping/ GC-MS no Prokaryota Serratia Marcescens NBII Headspace trapping/ GC-MS no Prokaryota Serratia Odorifera NBII Headspace trapping/ GC-MS no Prokaryota Burkholderia Ambifaria Luria-Bertani medium, Malt Extract n/a no Prokaryota Burkholderia Andropogonis Angle Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) no Prokaryota Bacillus Cereus Angle Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) no Prokaryota Burkholderia Anthina Angle Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) no Prokaryota Burkholderia Caledonica Angle Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) no Prokaryota Burkholderia Fungorum Angle Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) no Prokaryota Burkholderia Glathei LB Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) no Prokaryota Burkholderia Graminis LB and MR-VP Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) no Prokaryota Burkholderia Lata Angle Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) no Prokaryota Burkholderia Phenoliruptrix Angle Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) no Prokaryota Escherichia Coli MR-VP and Angle Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) no Prokaryota Serratia Marcescens LB Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) no Prokaryota Serratia Plymuthica LB and MS Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) no Prokaryota Serratia Plymuthica Angle Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) no Prokaryota Klebsiella Pneumoniae TS broth HS-SPME/GC-MS no Prokaryota Escherichia Coli TS broth GC-FID no Prokaryota Citrobacter Freundii TS broth GC-MS SPME yes Prokaryota Enterobacter Aerogenes TS broth GC-MS SPME yes Prokaryota Enterobacter Cloacae TS broth GC-MS SPME yes Prokaryota Escherichia Coli TS broth GC-MS SPME yes Prokaryota Salmonella Paratyphi TS broth GC-MS SPME yes Prokaryota Shigella Sonnei TS broth GC-MS SPME yes Prokaryota Enterococcus Durans TS broth GC-MS SPME yes Prokaryota Enterococcus Faecium TS broth GC-MS SPME yes Prokaryota Lactobacillus Lactis TS broth GC-MS SPME yes Prokaryota Leuconostoc Mesenteroides TS broth GC-MS SPME yes Prokaryota Streptococcus Thermophilus TS broth GC-MS SPME yes Prokaryota Pseudomonas Brassicacearum King's B Agar SPME-GC/MS no Prokaryota Pseudomonas Putida King's B Agar SPME-GC/MS no Prokaryota Bacillus Subtilis Murashige and Skoog medium capillary GC;GC/MS yes Prokaryota Bacillus Amyloliquefaciens Murashige and Skoog medium capillary GC;GC/MS yes Eukaryota Pleurotus Cystidiosus na GC/MS, GC-O, AEDA no Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a n/a no Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a n/a no Prokaryota Xanthomonas Campestris NBII Closed airflow-system/GC-MS and PTR-MS no Prokaryota Pseudochrobactrum Saccharolyticum LB liquid SPME-GC/MS no Prokaryota Wautersiella Falsenii LB liquid SPME-GC/MS no Prokaryota Achromobacter Sp. LB broth supplemented with cryoprotectant solution (25 g L−1 gelatin, 50 g L−1 lactose, 10 g L−1 peptone, and 250 g L−1 glycerol) SPME with gas chromatograph (Agilent 7890A, Agilent Technologies) connected to a mass spectrometer (Pegasus® HT TOFMS, LECO Corporation) no Prokaryota Serratia Sp. LB broth supplemented with cryoprotectant solution (25 g L−1 gelatin, 50 g L−1 lactose, 10 g L−1 peptone, and 250 g L−1 glycerol) SPME with gas chromatograph (Agilent 7890A, Agilent Technologies) connected to a mass spectrometer (Pegasus® HT TOFMS, LECO Corporation) no Prokaryota Enterobacter Sp. LB broth supplemented with cryoprotectant solution (25 g L−1 gelatin, 50 g L−1 lactose, 10 g L−1 peptone, and 250 g L−1 glycerol) SPME with gas chromatograph (Agilent 7890A, Agilent Technologies) connected to a mass spectrometer (Pegasus® HT TOFMS, LECO Corporation) no Prokaryota Bacillus Velezensis MOLP HS-SPME-GC/MS no Prokaryota Lactobacillus Plantarum chickpea milk UHPLC/MS no Lactobacillus Plantarum tuna cooking liquid HS-SPME-GC/MS no

Hexadecan-2-one

Compound Details

Synonymous names	2-HEXADECANONE Hexadecan-2-one 18787-63-8 LW5WI8V19D Methyl tetradecyl ketone EINECS 242-571-0 UNII-LW5WI8V19D BRN 1769889 AI3-33815 2-Hexadecanone, 98% 4-01-00-03393 (Beilstein Handbook Reference) SCHEMBL308802 CHEMBL3273568 DTXSID10172101 CHEBI:179359 LMFA12000187 MFCD00042873 AKOS009158706 AS-56549 CS-0336685 NS00021789 E78031 4-01-00-03393(Beilstein handbook reference) J-012093 Q27283217
Microorganism:	Yes
IUPAC name	hexadecan-2-one
SMILES	CCCCCCCCCCCCCCC(=O)C
Inchi	InChI=1S/C16H32O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16(2)17/h3-15H2,1-2H3
Formula	C16H32O
PubChem ID	29251
Molweight	240.42
LogP	6.8
Atoms	17
Bonds	13
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	ketones
CHEBI-ID	179359
Supernatural-ID	SN0426759

mVOC Specific Details

Boiling Point	Degree Reference 317 median
MS-Links	MS-MS Spectrum 18978 MS-MS Spectrum 18979 MS-MS Spectrum 18977 MS-MS Spectrum 12307 MS-MS Spectrum 12305 MS-MS Spectrum 12306
Massbank-Links	Massbank Spectrum MSBNK-Fac_Eng_Univ_Tokyo-JP008595

Species emitting the compound

Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Staphylococcus Epidermidis NA Timm et al. 2018 Prokaryota Bacillus Sp. antifungal activity against Fusarium solani Rhizosphere soil of avocado Guevara-Avendaño et al. 2019 Prokaryota Pseudomonas Sp. antifungal activity against Thielaviopsis ethacetica mycelial growth Brazilian Biorenewables National Laboratory – LNBR/CNPEM Microorganism Collection, Campinas, SP; isolatedfrom soil and roots of highly productive sugarcane-producing regions; Brazil Freitas et al. 2022 Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a NA Schulz and Dickschat 2007 Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a NA Dickschat et al. 2005_3 Eukaryota Pichia Kudriavzevii NA NA Mozūraitis et al. 2022 Eukaryota Pichia Membranifaciens NA NA Mozūraitis et al. 2022

Method

Kingdom Species Growth Medium Applied Method Verification Prokaryota Staphylococcus Epidermidis TSA SPME, GC-MS no Prokaryota Bacillus Sp. LB agar SPME-GC-MS no Prokaryota Pseudomonas Sp. LB media, DYGS media HS-SPME/GC-MS no Prokaryota Pseudomonas Sp. DYGS media HS-SPME/GC-MS no Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a n/a no Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a n/a no Eukaryota Pichia Kudriavzevii YPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar) SPME-GC-MS no Eukaryota Pichia Membranifaciens YPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar) SPME-GC-MS no

Pentadecan-2-one

Mass-Spectra

Compound Details

Synonymous names	2-PENTADECANONE Pentadecan-2-one 2345-28-0 Methyl tridecyl ketone Pentadecanone FEMA No. 3724 MFCD00053712 CHEBI:89254 B2Q48J997N UNII-B2Q48J997N 2-Pentandecanone EINECS 219-064-8 AI3-11706 SCHEMBL336157 2-PENTADECANONE [FHFI] 2-Pentadecanone, >=98.5% CHEMBL3273567 DTXSID6062333 FEMA 3724 2-Pentadecanone, >=98%, FG CAA34528 2-Pentadecanone, analytical standard LMFA12000056 AKOS009157795 AS-56748 SY049907 CS-0187603 NS00021893 Pentadecanone; 95%; Methyl n-tridecyl ketone D92066 A878236 J-015112 Q27161440 SSV
Microorganism:	Yes
IUPAC name	pentadecan-2-one
SMILES	CCCCCCCCCCCCCC(=O)C
Inchi	InChI=1S/C15H30O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15(2)16/h3-14H2,1-2H3
Formula	C15H30O
PubChem ID	61303
Molweight	226.4
LogP	6.3
Atoms	16
Bonds	12
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	ketones
CHEBI-ID	89254
Supernatural-ID	SN0047481

mVOC Specific Details

Boiling Point	Degree Reference 293 median
MS-Links	MS-MS Spectrum 14017 MS-MS Spectrum 7345 MS-MS Spectrum 14016 MS-MS Spectrum 7344 MS-MS Spectrum 14015 MS-MS Spectrum 7343
Massbank-Links	Massbank Spectrum MSBNK-Fac_Eng_Univ_Tokyo-JP006938

Species emitting the compound

Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Escherichia Coli NA NA Fitzgerald et al. 2021 Prokaryota Escherichia Coli NA NA Devaraj et al. 2018 Prokaryota Escherichia Coli NA NA Dixon et al. 2022 Prokaryota Lactobacillus Plantarum NA Yang et al. 2022 Prokaryota Corynebacterium Accolens clinical isolate Lemfack et al. 2016 Prokaryota Corynebacterium Jeikeium clinical isolate Lemfack et al. 2016 Prokaryota Corynebacterium Minutissimum clinical isolate,trunk of adult female Lemfack et al. 2016 Prokaryota Corynebacterium Striatum clinical isolate Lemfack et al. 2016 Prokaryota Staphylococcus Epidermidis NA Lemfack et al. 2016 Prokaryota Staphylococcus Epidermidis clinical isolate,nose Lemfack et al. 2016 Prokaryota Staphylococcus Epidermidis clinical isolate,catheter Lemfack et al. 2016 Prokaryota Staphylococcus Haemolyticus clinical isolate,human skin Lemfack et al. 2016 Prokaryota Staphylococcus Intermedius clinical isolate Lemfack et al. 2016 Prokaryota Staphylococcus Saccharolyticus clinical isolate Lemfack et al. 2016 Prokaryota Staphylococcus Schleiferi clinical isolate Lemfack et al. 2016 Prokaryota Staphylococcus Sciuri Southernflying squirrel skin Lemfack et al. 2016 Prokaryota Staphylococcus Sciuri clinical isolate Lemfack et al. 2016 Prokaryota Staphylococcus Warneri clinical isolate,human skin Lemfack et al. 2016 Prokaryota Bacillus Sp. KX395632.1 Fincheira et al. 2017 Prokaryota Staphylococcus Epidermidis NA Timm et al. 2018 Prokaryota Bacillus Sp. antifungal activity against Fusarium solani Rhizosphere soil of avocado Guevara-Avendaño et al. 2019 Prokaryota Pseudomonas Sp. antifungal activity against Thielaviopsis ethacetica mycelial growth Brazilian Biorenewables National Laboratory – LNBR/CNPEM Microorganism Collection, Campinas, SP; isolatedfrom soil and roots of highly productive sugarcane-producing regions; Brazil Freitas et al. 2022 Prokaryota Escherichia Coli Leibnitz Institute DSMZ-German Collection of Microorganisms and Cell Cultures GmbH Fitzgerald et al. 2020 Prokaryota Coraliitalea Coralii isolate from the algal Chromera velia CCAP 1602/1 Koteska et al. 2023 Prokaryota Erwinia Amylovora enhances Arabidopsis thaliana shoot and root growth bacterial collection of the Lab Parmagnani et al. 2023 Prokaryota Burkholderia Ambifaria NA Groenhagen et al. 2013 Prokaryota Serratia Plymuthica n/a NA Weise et al. 2014 Prokaryota Serratia Proteamaculans n/a NA Weise et al. 2014 Prokaryota Serratia Marcescens n/a NA Weise et al. 2014 Prokaryota Serratia Odorifera n/a NA Weise et al. 2014 Prokaryota Collimonas Fungivorans n/a NA Garbeva et al. 2014 Prokaryota Bacillus Subtilis antibacterial soil Malaysia and Tibet, China General Microbial culture center CGMCC Xie et al. 2018 Eukaryota Fusarium Solani NA Takeuchi et al. 2012 Prokaryota Pseudomonas Brassicacearum na rhizosphere of bean plants, southern Italy Giorgio et al. 2015 Prokaryota Pseudomonas Syringae na phyllosphere of field-grown potato plants Hunziker et al. 2015 Prokaryota Serratia Plymuthica na maize rhizosphere, Netherlands Garbeva et al. 2014 Eukaryota Pleurotus Cystidiosus na na Usami et al. 2014 Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB)M n/a NA Schulz and Dickschat 2007 Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a NA Dickschat et al. 2005_3 Prokaryota Xanthomonas Campestris n/a NA Weise et al. 2012 Eukaryota Pichia Kudriavzevii NA NA Mozūraitis et al. 2022 Eukaryota Pichia Membranifaciens NA NA Mozūraitis et al. 2022 Eukaryota Saccharomyces Paradoxus NA NA Mozūraitis et al. 2022 Prokaryota Bacillus Subtilis NA NA Lee et al. 2023

Method

Kingdom Species Growth Medium Applied Method Verification Prokaryota Escherichia Coli TSB SPME/GC-MS no Prokaryota Escherichia Coli LB SPME/GC-MS no Prokaryota Escherichia Coli BHI SPME/GC-MS no Prokaryota Escherichia Coli TSA TD/GC-MS no Prokaryota Escherichia Coli LB TD/GC-MS no Prokaryota Lactobacillus Plantarum ginkgo biloba kernel juice triple quadrupole GC-MS no Prokaryota Corynebacterium Accolens brain heart infusion medium Porapak / GC/MS no Prokaryota Corynebacterium Jeikeium brain heart infusion medium Porapak / GC/MS no Prokaryota Corynebacterium Minutissimum brain heart infusion medium Porapak / GC/MS no Prokaryota Corynebacterium Striatum brain heart infusion medium Porapak / GC/MS no Prokaryota Staphylococcus Epidermidis brain heart infusion medium Porapak / GC/MS no Prokaryota Staphylococcus Haemolyticus brain heart infusion medium Porapak / GC/MS no Prokaryota Staphylococcus Intermedius brain heart infusion medium Porapak / GC/MS no Prokaryota Staphylococcus Saccharolyticus brain heart infusion medium Porapak / GC/MS no Prokaryota Staphylococcus Schleiferi brain heart infusion medium Porapak / GC/MS no Prokaryota Staphylococcus Sciuri brain heart infusion medium Porapak / GC/MS no Prokaryota Staphylococcus Warneri brain heart infusion medium Porapak / GC/MS no Prokaryota Bacillus Sp. Plate Count agar (PCA) GC–MS yes Prokaryota Bacillus Sp. Methyl Red & Voges Proskauer broth (MRVP-B) SPME, GC-MS yes Prokaryota Staphylococcus Epidermidis TSA SPME, GC-MS no Prokaryota Bacillus Sp. LB agar SPME-GC-MS no Prokaryota Pseudomonas Sp. LB media, DYGS media HS-SPME/GC-MS no Prokaryota Escherichia Coli TSB media HS-SPME/GC-MS no Prokaryota Coraliitalea Coralii marine broth agar OSSA/GC-MS no Prokaryota Erwinia Amylovora SBSE/GC-MS no Prokaryota Burkholderia Ambifaria Luria-Bertani medium, Malt Extract yes Prokaryota Serratia Plymuthica NBII Headspace trapping/ GC-MS no Prokaryota Serratia Proteamaculans NBII Headspace trapping/ GC-MS no Prokaryota Serratia Marcescens NBII Headspace trapping/ GC-MS no Prokaryota Serratia Odorifera NBII Headspace trapping/ GC-MS no Prokaryota Collimonas Fungivorans Headspace trapping/GC-MS no Prokaryota Bacillus Subtilis LB SPME-GC-MS yes Eukaryota Fusarium Solani no Prokaryota Pseudomonas Brassicacearum King's B Agar SPME-GC/MS no Prokaryota Pseudomonas Syringae LB medium GC/MS yes Prokaryota Serratia Plymuthica sand containing artificial root exudates GC/MS no Eukaryota Pleurotus Cystidiosus na GC/MS, GC-O, AEDA no Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB)M n/a n/a no Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a n/a no Prokaryota Xanthomonas Campestris NBII Closed airflow-system/GC-MS and PTR-MS no Eukaryota Pichia Kudriavzevii YPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar) SPME-GC-MS no Eukaryota Pichia Membranifaciens YPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar) SPME-GC-MS no Eukaryota Saccharomyces Paradoxus YPD-agar plates (1% yeast extract, 1% peptone, 2% dextrose, 2% agar) SPME-GC-MS no Prokaryota Bacillus Subtilis Tryptone soy broth (TSB) HPLC no

Tetradecan-2-one

Mass-Spectra

Compound Details

Synonymous names	2-Tetradecanone Tetradecan-2-one 2345-27-9 Dodecyl Methyl Ketone methyl dodecyl ketone EINECS 219-063-2 6XQM5Y5KKR SCHEMBL162632 CHEBI:89818 DTXSID10177999 CAA34527 LMFA12000177 MFCD00060927 AKOS009159000 AS-56658 CS-0149221 NS00048819 T1314 T72124 Q27162006
Microorganism:	Yes
IUPAC name	tetradecan-2-one
SMILES	CCCCCCCCCCCCC(=O)C
Inchi	InChI=1S/C14H28O/c1-3-4-5-6-7-8-9-10-11-12-13-14(2)15/h3-13H2,1-2H3
Formula	C14H28O
PubChem ID	75364
Molweight	212.37
LogP	5.7
Atoms	15
Bonds	11
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	ketones
CHEBI-ID	89818
Supernatural-ID	SN0291092

mVOC Specific Details

Boiling Point	Degree Reference 279 median
MS-Links	MS-MS Spectrum 82572 MS-MS Spectrum 82573 MS-MS Spectrum 143973 MS-MS Spectrum 143975 MS-MS Spectrum 143974 MS-MS Spectrum 82574
Massbank-Links	Massbank Spectrum MSBNK-Fac_Eng_Univ_Tokyo-JP008594

Species emitting the compound

Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Staphylococcus Epidermidis NA Timm et al. 2018 Prokaryota Bacillus Sp. antifungal activity against Fusarium solani Rhizosphere soil of avocado Guevara-Avendaño et al. 2019 Prokaryota Staphylococcus Aureus American Type Culture Collection Jenkins and Bean 2020 Prokaryota Staphylococcus Epidermidis American Type Culture Collection Jenkins and Bean 2020 Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a NA Schulz and Dickschat 2007 Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a NA Dickschat et al. 2005_3

Method

Kingdom Species Growth Medium Applied Method Verification Prokaryota Staphylococcus Epidermidis TSA SPME, GC-MS no Prokaryota Bacillus Sp. LB agar SPME-GC-MS no Prokaryota Staphylococcus Aureus BHI media, LB media, MHB media HS-SPME/GC×GC-TOFMS no Prokaryota Staphylococcus Epidermidis MHB media HS-SPME/GC×GC-TOFMS no Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a n/a no Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a n/a no

13-methyltetradecan-2-one

Compound Details

Synonymous names	13-methyltetradecan-2-one SCHEMBL8896028
Microorganism:	Yes
IUPAC name	13-methyltetradecan-2-one
SMILES	CC(C)CCCCCCCCCCC(=O)C
Inchi	InChI=1S/C15H30O/c1-14(2)12-10-8-6-4-5-7-9-11-13-15(3)16/h14H,4-13H2,1-3H3
Formula	C15H30O
PubChem ID	19931290
Molweight	226.4
LogP	6
Atoms	16
Bonds	11
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	ketones

mVOC Specific Details

Species emitting the compound	Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Coraliitalea Coralii isolate from the algal Chromera velia CCAP 1602/1 Koteska et al. 2023 Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a NA Schulz and Dickschat 2007 Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a NA Dickschat et al. 2005_3 Prokaryota Xanthomonas Campestris n/a NA Weise et al. 2012
Method	Kingdom Species Growth Medium Applied Method Verification Prokaryota Coraliitalea Coralii marine broth agar OSSA/GC-MS no Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a n/a no Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a n/a no Prokaryota Xanthomonas Campestris NBII Closed airflow-system/GC-MS and PTR-MS no

13-methyltetradecan-3-one

Compound Details

Synonymous names	13-methyltetradecan-3-one SCHEMBL8898652
Microorganism:	Yes
IUPAC name	13-methyltetradecan-3-one
SMILES	CCC(=O)CCCCCCCCCC(C)C
Inchi	InChI=1S/C15H30O/c1-4-15(16)13-11-9-7-5-6-8-10-12-14(2)3/h14H,4-13H2,1-3H3
Formula	C15H30O
PubChem ID	19931435
Molweight	226.4
LogP	5.8
Atoms	16
Bonds	11
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	ketones

mVOC Specific Details

Species emitting the compound	Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Coraliitalea Coralii isolate from the algal Chromera velia CCAP 1602/1 Koteska et al. 2023 Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a NA Schulz and Dickschat 2007 Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a NA Dickschat et al. 2005_3
Method	Kingdom Species Growth Medium Applied Method Verification Prokaryota Coraliitalea Coralii marine broth agar OSSA/GC-MS no Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a n/a no Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a n/a no

11-methyldodecan-2-one

Compound Details

Synonymous names	11-methyldodecan-2-one SCHEMBL18314426 CHEBI:225563 GYPFCEFVMRJITR-UHFFFAOYSA-N
Microorganism:	Yes
IUPAC name	11-methyldodecan-2-one
SMILES	CC(C)CCCCCCCCC(=O)C
Inchi	InChI=1S/C13H26O/c1-12(2)10-8-6-4-5-7-9-11-13(3)14/h12H,4-11H2,1-3H3
Formula	C13H26O
PubChem ID	21427346
Molweight	198.34
LogP	4.9
Atoms	14
Bonds	9
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	ketones
CHEBI-ID	225563
Supernatural-ID	SN0118812

mVOC Specific Details

Species emitting the compound	Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Coraliitalea Coralii isolate from the algal Chromera velia CCAP 1602/1 Koteska et al. 2023 Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a NA Schulz and Dickschat 2007 Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a NA Dickschat et al. 2005_3 Prokaryota Xanthomonas Campestris n/a NA Weise et al. 2012
Method	Kingdom Species Growth Medium Applied Method Verification Prokaryota Coraliitalea Coralii marine broth agar OSSA/GC-MS no Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a n/a no Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a n/a no Prokaryota Xanthomonas Campestris NBII Closed airflow-system/GC-MS and PTR-MS no

13-methylpentadecan-2-one

Compound Details

Synonymous names	13-methylpentadecan-2-one SCHEMBL11893269
Microorganism:	Yes
IUPAC name	13-methylpentadecan-2-one
SMILES	CCC(C)CCCCCCCCCCC(=O)C
Inchi	InChI=1S/C16H32O/c1-4-15(2)13-11-9-7-5-6-8-10-12-14-16(3)17/h15H,4-14H2,1-3H3
Formula	C16H32O
PubChem ID	88850022
Molweight	240.42
LogP	6.4
Atoms	17
Bonds	12
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	ketones

mVOC Specific Details

Species emitting the compound

Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Coraliitalea Coralii isolate from the algal Chromera velia CCAP 1602/1 Koteska et al. 2023 Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a NA Schulz and Dickschat 2007 Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a NA Dickschat et al. 2005_3 Prokaryota Xanthomonas Campestris n/a phyllosphere of the plant (Capsicum sp.) Weise et al. 2012

Method

Kingdom Species Growth Medium Applied Method Verification Prokaryota Coraliitalea Coralii marine broth agar OSSA/GC-MS no Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a n/a no Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a n/a no Prokaryota Xanthomonas Campestris NBII The bacteria was grow at 30°C in closed airflow-system for VOCs collection VOCs were analyzed by GC/MS and PTR-MS no

12-methyltridecan-2-one

Compound Details

Synonymous names	12-methyltridecan-2-one SCHEMBL12526756
Microorganism:	Yes
IUPAC name	12-methyltridecan-2-one
SMILES	CC(C)CCCCCCCCCC(=O)C
Inchi	InChI=1S/C14H28O/c1-13(2)11-9-7-5-4-6-8-10-12-14(3)15/h13H,4-12H2,1-3H3
Formula	C14H28O
PubChem ID	88931455
Molweight	212.37
LogP	5.4
Atoms	15
Bonds	10
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	ketones

mVOC Specific Details

Species emitting the compound

Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Coraliitalea Coralii isolate from the algal Chromera velia CCAP 1602/1 Koteska et al. 2023 Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a NA Schulz and Dickschat 2007 Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a NA Dickschat et al. 2005_3 Prokaryota Xanthomonas Campestris n/a phyllosphere of the plant (Capsicum sp.) Weise et al. 2012

Method

Kingdom Species Growth Medium Applied Method Verification Prokaryota Coraliitalea Coralii marine broth agar OSSA/GC-MS no Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a n/a no Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a n/a no Prokaryota Xanthomonas Campestris NBII The bacteria was grow at 30°C in closed airflow-system for VOCs collection VOCs were analyzed by GC/MS and PTR-MS no

14-methylpentadecan-2-one

Compound Details

Synonymous names	14-methylpentadecan-2-one SCHEMBL15026773
Microorganism:	Yes
IUPAC name	14-methylpentadecan-2-one
SMILES	CC(C)CCCCCCCCCCCC(=O)C
Inchi	InChI=1S/C16H32O/c1-15(2)13-11-9-7-5-4-6-8-10-12-14-16(3)17/h15H,4-14H2,1-3H3
Formula	C16H32O
PubChem ID	89625099
Molweight	240.42
LogP	6.5
Atoms	17
Bonds	12
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	ketones

mVOC Specific Details

Species emitting the compound

Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Staphylococcus Epidermidis NA Lemfack et al. 2016 Prokaryota Staphylococcus Epidermidis clinical isolate,nose Lemfack et al. 2016 Prokaryota Staphylococcus Epidermidis clinical isolate,catheter Lemfack et al. 2016 Prokaryota Staphylococcus Haemolyticus clinical isolate,human skin Lemfack et al. 2016 Prokaryota Staphylococcus Saccharolyticus clinical isolate Lemfack et al. 2016 Prokaryota Staphylococcus Schleiferi clinical isolate Lemfack et al. 2016 Prokaryota Staphylococcus Warneri clinical isolate,human skin Lemfack et al. 2016 Prokaryota Coraliitalea Coralii isolate from the algal Chromera velia CCAP 1602/1 Koteska et al. 2023 Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a NA Schulz and Dickschat 2007 Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a NA Dickschat et al. 2005_3 Prokaryota Xanthomonas Campestris n/a phyllosphere of the plant (Capsicum sp.) Weise et al. 2012

Method

Kingdom Species Growth Medium Applied Method Verification Prokaryota Staphylococcus Epidermidis brain heart infusion medium Porapak / GC/MS no Prokaryota Staphylococcus Haemolyticus brain heart infusion medium Porapak / GC/MS no Prokaryota Staphylococcus Saccharolyticus brain heart infusion medium Porapak / GC/MS no Prokaryota Staphylococcus Schleiferi brain heart infusion medium Porapak / GC/MS no Prokaryota Staphylococcus Warneri brain heart infusion medium Porapak / GC/MS no Prokaryota Coraliitalea Coralii marine broth agar OSSA/GC-MS no Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a n/a no Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a n/a no Prokaryota Xanthomonas Campestris NBII The bacteria was grow at 30°C in closed airflow-system for VOCs collection VOCs were analyzed by GC/MS and PTR-MS no

(Z)-hexadec-8-en-2-one

Compound Details

Synonymous names	Hexadec-8-en-2-one (z)-8-hexadecen-2-one (Z)-hexadec-8-en-2-one CHEBI:202943
Microorganism:	Yes
IUPAC name	(Z)-hexadec-8-en-2-one
SMILES	CCCCCCCC=CCCCCCC(=O)C
Inchi	InChI=1S/C16H30O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16(2)17/h9-10H,3-8,11-15H2,1-2H3/b10-9-
Formula	C16H30O
PubChem ID	129776278
Molweight	238.41
LogP	6
Atoms	17
Bonds	12
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	ketones
CHEBI-ID	202943
Supernatural-ID	SN0364596-01

mVOC Specific Details

Species emitting the compound	Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) Shows antibiotic activity against Agrobacterium. NA Schulz and Dickschat 2007 Prokaryota Cytophaga-Flavobacterium-Bacteroides Inhibited growth of Agrobacterium tumefaciens. NA Dickschat et al. 2005_3
Method	Kingdom Species Growth Medium Applied Method Verification Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a n/a no Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a n/a no

12-methyltetradecan-3-one

Compound Details

Synonymous names	12-Methyltetradecan-3-one
Microorganism:	Yes
IUPAC name	12-methyltetradecan-3-one
SMILES	CCC(C)CCCCCCCCC(=O)CC
Inchi	InChI=1S/C15H30O/c1-4-14(3)12-10-8-6-7-9-11-13-15(16)5-2/h14H,4-13H2,1-3H3
Formula	C15H30O
PubChem ID	139584723
Molweight	226.4
LogP	5.8
Atoms	16
Bonds	11
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	ketones
CHEBI-ID	202986
Supernatural-ID	SN0027274

mVOC Specific Details

Species emitting the compound	Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Coraliitalea Coralii isolate from the algal Chromera velia CCAP 1602/1 Koteska et al. 2023 Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a NA Schulz and Dickschat 2007 Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a NA Dickschat et al. 2005_3
Method	Kingdom Species Growth Medium Applied Method Verification Prokaryota Coraliitalea Coralii marine broth agar OSSA/GC-MS no Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a n/a no Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a n/a no

(11S)-11-methyltridecan-2-one

Compound Details

Synonymous names	11-methyltridecan-2-one CHEBI:213162
Microorganism:	Yes
IUPAC name	(11S)-11-methyltridecan-2-one
SMILES	CCC(C)CCCCCCCCC(=O)C
Inchi	InChI=1S/C14H28O/c1-4-13(2)11-9-7-5-6-8-10-12-14(3)15/h13H,4-12H2,1-3H3/t13-/m0/s1
Formula	C14H28O
PubChem ID	162939961
Molweight	212.37
LogP	5.4
Atoms	15
Bonds	10
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	ketones
CHEBI-ID	213162
Supernatural-ID	SN0324851-01

mVOC Specific Details

Species emitting the compound

Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Coraliitalea Coralii isolate from the algal Chromera velia CCAP 1602/1 Koteska et al. 2023 Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a NA Schulz and Dickschat 2007 Prokaryota Streptomyces Caviscabies n/a NA Schulz and Dickschat 2007 Prokaryota Stigmatella Aurantiaca n/a NA Schulz and Dickschat 2007 Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a NA Dickschat et al. 2005_3 Prokaryota Xanthomonas Campestris n/a phyllosphere of the plant (Capsicum sp.) Weise et al. 2012

Method

Kingdom Species Growth Medium Applied Method Verification Prokaryota Coraliitalea Coralii marine broth agar OSSA/GC-MS no Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a n/a no Prokaryota Streptomyces Caviscabies n/a n/a no Prokaryota Stigmatella Aurantiaca n/a n/a no Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a n/a no Prokaryota Xanthomonas Campestris NBII The bacteria was grow at 30°C in closed airflow-system for VOCs collection VOCs were analyzed by GC/MS and PTR-MS no

(12S)-12-methyltetradecan-2-one

Compound Details

Synonymous names	12-Methyltetradecan-2-one CHEBI:205522
Microorganism:	Yes
IUPAC name	(12S)-12-methyltetradecan-2-one
SMILES	CCC(C)CCCCCCCCCC(=O)C
Inchi	InChI=1S/C15H30O/c1-4-14(2)12-10-8-6-5-7-9-11-13-15(3)16/h14H,4-13H2,1-3H3/t14-/m0/s1
Formula	C15H30O
PubChem ID	163062952
Molweight	226.4
LogP	5.9
Atoms	16
Bonds	11
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	ketones
CHEBI-ID	205522
Supernatural-ID	SN0150595-01

mVOC Specific Details

Species emitting the compound	Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a NA Schulz and Dickschat 2007 Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a NA Dickschat et al. 2005_3
Method	Kingdom Species Growth Medium Applied Method Verification Prokaryota Cytophaga-Flavobacterium-Bacteroides (CFB) n/a n/a no Prokaryota Cytophaga-Flavobacterium-Bacteroides n/a n/a no