Results for:
PubChem ID: 12741

Decan-2-one

Mass-Spectra

Compound Details

Synonymous names	2-Decanone Decan-2-one 693-54-9 METHYL OCTYL KETONE Methyl n-octyl ketone Octyl methyl ketone n-C8H17COCH3 MFCD00009571 GX543OLT0R CHEMBL47127 DTXSID9022104 CHEBI:77929 2-Decanone, >=98% EINECS 211-752-6 UNII-GX543OLT0R BRN 1747463 2-Decanone, 98% 2-DECANONE [FHFI] 4-01-00-03367 (Beilstein Handbook Reference) SCHEMBL103053 DTXCID002104 2-Decanone, analytical standard FEMA NO. 4271 Tox21_303799 BDBM50409665 LMFA12000044 AKOS009158912 NCGC00357084-01 AS-56271 CAS-693-54-9 SY020322 DB-003265 D1643 NS00022695 D89897 EN300-170618 A836446 Q20054515
Microorganism:	Yes
IUPAC name	decan-2-one
SMILES	CCCCCCCCC(=O)C
Inchi	InChI=1S/C10H20O/c1-3-4-5-6-7-8-9-10(2)11/h3-9H2,1-2H3
Formula	C10H20O
PubChem ID	12741
Molweight	156.26
LogP	3.7
Atoms	11
Bonds	7
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	ketones
CHEBI-ID	77929
Supernatural-ID	SN0465109

mVOC Specific Details

Boiling Point	Degree Reference 210 median
MS-Links	MS-MS Spectrum 133043 MS-MS Spectrum 73802 MS-MS Spectrum 133041 MS-MS Spectrum 133042 MS-MS Spectrum 73801 MS-MS Spectrum 73800
1D-NMR-Links	1D NMR Spectrum 4247 1D NMR Spectrum 3964
Massbank-Links	Massbank Spectrum MSBNK-Fac_Eng_Univ_Tokyo-JP007043

Species emitting the compound

Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Pseudomonas Aeruginosa NA NA Bean et al. 2016 Prokaryota Pseudomonas Aeruginosa NA NA Davis et al. 2020 Prokaryota Escherichia Coli NA NA Devaraj et al. 2018 Prokaryota Enterobacter Cloacae NA NA Jünger et al. 2012 Prokaryota Escherichia Coli NA NA Jünger et al. 2012 Prokaryota Serratia Marcescens NA NA Jünger et al. 2012 Prokaryota Bacillus Sp. antifungal activity against Fusarium solani Rhizosphere soil of avocado Guevara-Avendaño et al. 2019 Prokaryota Klebsiella Pneumoniae clinical isolate,bacteremic patients Rees et al. 2017 Prokaryota Bacillus Subtilis Zhang et al. 2021 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 Paenibacillus Polymyxa NA Mülner et al. 2021 Prokaryota Escherichia Coli Leibnitz Institute DSMZ-German Collection of Microorganisms and Cell Cultures GmbH Fitzgerald et al. 2020 Prokaryota Bacillus Velezensis growth stimulation effects on Solanum tuberosum tubers (potato) and Zea mays seeds (maize) NA Mülner et al. 2020 Prokaryota Paenibacillus Polymyxa antifungal effects against Rhizopus stolonifer isolated from an ancient tree Cryptomeria fortune and deposited in China General Microbiological Culture Collection Center (CGMCC No. 15733) Wu et al. 2020 Prokaryota Staphylococcus Aureus American Type Culture Collection Jenkins and Bean 2020 Prokaryota Staphylococcus Epidermidis American Type Culture Collection Jenkins and Bean 2020 Prokaryota Streptomyces Philanthi antifungal activity against Aspergillus parasiticus TISTR 3276 and Aspergillus flavus PSRDC-4 NA Boukaew and Prasertsan 2020 Prokaryota Serratia Marcescens n/a NA Weise et al. 2014 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 Bacillus Cereus n/a NA Blom et al. 2011 Prokaryota Burkholderia Andropogonis 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 Caribensis n/a NA Blom et al. 2011 Prokaryota Burkholderia Caryophylli n/a NA Blom et al. 2011 Prokaryota Burkholderia Fungorum n/a NA Blom et al. 2011 Prokaryota Burkholderia Gladioli n/a NA Blom et al. 2011 Prokaryota Burkholderia Glathei n/a NA Blom et al. 2011 Prokaryota Burkholderia Glumae n/a NA Blom et al. 2011 Prokaryota Burkholderia Graminis n/a NA Blom et al. 2011 Prokaryota Burkholderia Kururiensis n/a NA Blom et al. 2011 Prokaryota Burkholderia Lata n/a NA Blom et al. 2011 Prokaryota Burkholderia Phenazinium n/a NA Blom et al. 2011 Prokaryota Burkholderia Phytofirmans n/a NA Blom et al. 2011 Prokaryota Burkholderia Pyrrocinia n/a NA Blom et al. 2011 Prokaryota Burkholderia Thailandensis n/a NA Blom et al. 2011 Prokaryota Cellulomonas Uda n/a NA Blom et al. 2011 Prokaryota Pseudomonas Chlororaphis n/a NA Blom et al. 2011 Prokaryota Serratia Entomophila 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 Pseudomonas Jessenii na phyllosphere of field-grown potato plants Hunziker et al. 2015 Prokaryota Serratia Plymuthica na maize rhizosphere, Netherlands Garbeva et al. 2014 Prokaryota Collimonas Pratensis na rhizosphere of Marram grass in sandy dune soils, Netherlands Garbeva et al. 2014 Prokaryota Paenibacillus Sp. na rhizosphere of Marram grass in sandy dune soils, Netherlands Garbeva et al. 2014 Prokaryota Pedobacter Sp. na rhizosphere of Marram grass in sandy dune soils, Netherlands Garbeva et al. 2014 Eukaryota Spongiporus Leucomallellus na saprophytic mostly on wet, old pines Campos Ziegenbein et al. 2006 Prokaryota Cyanobacteria Sp. n/a NA Schulz and Dickschat 2007 Prokaryota Xanthomonas Campestris n/a NA Weise et al. 2012 Prokaryota Wautersiella Falsenii Nematicidal activity cow dung XU et al. 2015 Prokaryota Paenibacillus Polymyxa collection TU Graz Rybakova et al. 2017 Prokaryota Achromobacter Sp. NA NA Almeida et al. 2022

Method

Kingdom Species Growth Medium Applied Method Verification Prokaryota Pseudomonas Aeruginosa LB-Lennox SPME/GC-MS no Prokaryota Pseudomonas Aeruginosa LB broth SPME/GCxGC-MS no Prokaryota Escherichia Coli TSA TD/GC-MS no Prokaryota Enterobacter Cloacae Columbia sheep blood TD/GC-MS and MCC-IMS no Prokaryota Escherichia Coli Columbia sheep blood TD/GC-MS and MCC-IMS no Prokaryota Serratia Marcescens Columbia sheep blood TD/GC-MS and MCC-IMS no Prokaryota Bacillus Sp. LB agar SPME-GC-MS no Prokaryota Klebsiella Pneumoniae BHI, LB, MHB, TSB SPME / GCxGC-TOFMS no Prokaryota Bacillus Subtilis LB media HS-SPME/GC-MS no Prokaryota Pseudomonas Sp. LB media, DYGS media HS-SPME/GC-MS no Prokaryota Paenibacillus Polymyxa NA media, LB media, TSA media, Landy media HS-SPME/GC-MS no Prokaryota Paenibacillus Polymyxa NA media, Landy media HS-SPME/GC-MS no Prokaryota Escherichia Coli TSB media HS-SPME/GC-MS no Prokaryota Bacillus Velezensis nutrient agar HS-SPME/GC-MS no Prokaryota Paenibacillus Polymyxa LB agar and M49 (minimal) media SPME/GC-MS no Prokaryota Staphylococcus Aureus BHI media, LB media HS-SPME/GC×GC-TOFMS no Prokaryota Staphylococcus Epidermidis BHI media, LB media HS-SPME/GC×GC-TOFMS no Prokaryota Streptomyces Philanthi sterile wheat seeds GC-MS no Prokaryota Serratia Marcescens NBII Headspace trapping/ GC-MS 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 Bacillus Cereus LB Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) no Prokaryota Burkholderia Andropogonis LB Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) no Prokaryota Burkholderia Anthina 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 Caledonica 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 Caribensis 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 Caryophylli LB, 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 Burkholderia Fungorum 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 Gladioli 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 Glathei 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 Glumae 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 Graminis 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 Kururiensis LB Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) no Prokaryota Burkholderia Lata 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 Phenazinium 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 Phytofirmans 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 Pyrrocinia 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 Thailandensis LB, MR-VP, MS and Angle Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) no Prokaryota Cellulomonas Uda LB, 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 Pseudomonas Chlororaphis MR-VP Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) no Prokaryota Serratia Entomophila LB 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, MS 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 Serratia Plymuthica LB, MS 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 Serratia Plymuthica LB Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD) no Prokaryota Pseudomonas Jessenii LB medium GC/MS yes Prokaryota Serratia Plymuthica sand containing artificial root exudates GC/MS no Prokaryota Collimonas Pratensis sand containing artificial root exudates GC/MS no Prokaryota Paenibacillus Sp. sand containing artificial root exudates GC/MS no Prokaryota Pedobacter Sp. sand containing artificial root exudates GC/MS no Eukaryota Spongiporus Leucomallellus na GC/MS no Prokaryota Cyanobacteria Sp. n/a n/a no Prokaryota Xanthomonas Campestris NBII Closed airflow-system/GC-MS and PTR-MS no Prokaryota Wautersiella Falsenii LB liquid SPME-GC/MS no Prokaryota Paenibacillus Polymyxa GC-MS / SPME 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