Results for:
PubChem ID: 28965

5-methylheptan-2-one

Mass-Spectra

Compound Details

Synonymous names	5-methylheptan-2-one 5-METHYL-2-HEPTANONE 18217-12-4 2-Heptanone, 5-methyl- 5-methyl-heptan-2-one SCHEMBL408474 DTXSID30939531 CHEBI:195863 LMFA12000050 AKOS011384478 CS-0243170 NS00113874 E85086 EN300-260263 Z955111260
Microorganism:	Yes
IUPAC name	5-methylheptan-2-one
SMILES	CCC(C)CCC(=O)C
Inchi	InChI=1S/C8H16O/c1-4-7(2)5-6-8(3)9/h7H,4-6H2,1-3H3
Formula	C8H16O
PubChem ID	28965
Molweight	128.21
LogP	2.4
Atoms	9
Bonds	4
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	ketones
CHEBI-ID	195863
Supernatural-ID	SN0423147

mVOC Specific Details

Species emitting the compound

Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Bacillus Sp. antifungal activity against Fusarium solani Rhizosphere soil of avocado Guevara-Avendaño et al. 2019 Prokaryota Bacillus Subtilis Zhang et al. 2021 Prokaryota Staphylococcus Epidermidis strains were provided by Prof. O'Gara at NUI Galway Fitzgerald et al. 2020 Prokaryota Stenotrophomonas Maltophilia antifungal effect on the growth of Alternaria alternata, Corynespora cassiicola and Stemphylium lycopersici (pathogens of tomato plants) shoots of tomato plants (Elpida F1, Enza Zaden) López et al. 2021 Prokaryota Staphylococcus Pasteuri antifungal effect on the growth of Alternaria alternata, Corynespora cassiicola and Stemphylium lycopersici (pathogens of tomato plants) fruits of tomato plants (Elpida F1, Enza Zaden) López et al. 2021 Prokaryota Bacillus Velezensis NA Mülner et al. 2020 Prokaryota Coraliitalea Coralii isolate from the algal Chromera velia CCAP 1602/1 Koteska et al. 2023 Eukaryota Tuber Melanosporum n/a Agricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain). Diaz et al. 2003 Prokaryota Streptomyces Caviscabies n/a NA Schulz and Dickschat 2007 Prokaryota Streptomyces Sp. n/a NA Dickschat et al. 2005_2 Prokaryota Xanthomonas Campestris n/a NA Weise et al. 2012 Prokaryota Bacillus Atrophaeus NA NA Toral et al. 2021

Method

Kingdom Species Growth Medium Applied Method Verification Prokaryota Bacillus Sp. LB agar SPME-GC-MS no Prokaryota Bacillus Subtilis LB media HS-SPME/GC-MS no Prokaryota Staphylococcus Epidermidis TSB media HS-SPME/GC-MS no Prokaryota Stenotrophomonas Maltophilia TYB media GC-MS no Prokaryota Staphylococcus Pasteuri TYB media GC-MS no Prokaryota Bacillus Velezensis nutrient agar HS-SPME/GC-MS no Prokaryota Coraliitalea Coralii marine broth agar OSSA/GC-MS no Eukaryota Tuber Melanosporum n/a Headspace solid-phase microextraction (HS-SPME) combined with GC-MS no Prokaryota Streptomyces Caviscabies n/a n/a no Prokaryota Streptomyces Sp. n/a n/a no Prokaryota Xanthomonas Campestris NBII Closed airflow-system/GC-MS and PTR-MS no Prokaryota Bacillus Atrophaeus MOLP HS-SPME-GC/MS no Prokaryota Bacillus Atrophaeus Schaeffer’s growth (SG) medium HS-SPME-GC/MS no Prokaryota Bacillus Atrophaeus tryptic soy agar (TSA, Panreac Applichem) medium HS-SPME-GC/MS no