Results for:
PubChem ID: 78236

Nonan-4-one

Mass-Spectra

Compound Details

Synonymous names	4-Nonanone 4485-09-0 Nonan-4-one Amyl Propyl Ketone Propyl amyl ketone Pentyl Propyl Ketone n-Pentyl n-propyl ketone EINECS 224-770-4 SCHEMBL129432 DTXSID5063493 CHEBI:179604 LMFA12000148 MFCD00027286 AKOS009157392 DB-051253 CS-0362557 N0427 NS00022200 D91706 A902353 Q31838919 InChI=1/C9H18O/c1-3-5-6-8-9(10)7-4-2/h3-8H2,1-2H
Microorganism:	Yes
IUPAC name	nonan-4-one
SMILES	CCCCCC(=O)CCC
Inchi	InChI=1S/C9H18O/c1-3-5-6-8-9(10)7-4-2/h3-8H2,1-2H3
Formula	C9H18O
PubChem ID	78236
Molweight	142.24
LogP	2.8
Atoms	10
Bonds	6
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	ketones
CHEBI-ID	179604
Supernatural-ID	SN0363152

mVOC Specific Details

Boiling Point	Degree Reference 188 median
MS-Links	MS-MS Spectrum 122317 MS-MS Spectrum 122318 MS-MS Spectrum 52549 MS-MS Spectrum 122316 MS-MS Spectrum 52548 MS-MS Spectrum 52550
Massbank-Links	Massbank Spectrum MSBNK-Fac_Eng_Univ_Tokyo-JP002579

Species emitting the compound

Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Pseudomonas Aeruginosa NA NA Davis et al. 2020 Prokaryota Escherichia Coli Swedish Institute for Communicable Disease Control (SMI), Stockholm, Sweden Sousa et al. 2023 Eukaryota Xylaria Sp. na Haematoxylon brasiletto, Morelos, Mexico Sánchez-Ortiz et al. 2016 Eukaryota Muscodor Sp. NA Ezra et al. 2004 Prokaryota Lentilactobacillus Buchneri NA NA Squara et al. 2022 Eukaryota Metschnikowia Saccharicola NA NA Ljunggren et al. 2019

Method

Kingdom Species Growth Medium Applied Method Verification Prokaryota Pseudomonas Aeruginosa LB broth SPME/GCxGC-MS no Prokaryota Escherichia Coli rocket lysate HS-SPME/GC-MS no Eukaryota Xylaria Sp. PDA medium SPME-GC/MS yes Eukaryota Muscodor Sp. no Prokaryota Lentilactobacillus Buchneri maize silage HS-SPME coupled with GC-TOF MS no Eukaryota Metschnikowia Saccharicola liquid YPD medium GC-MS no