Results for:
PubChem ID: 61177

Hexyl Formate

Mass-Spectra

Compound Details

Synonymous names	Hexyl formate n-Hexyl formate 629-33-4 FORMIC ACID, HEXYL ESTER n-Hexyl methanoate Hexyl methanoate Formic Acid Hexyl Ester FEMA No. 2570 Hexyl formiate 9GPU7PGV1G NSC-4780 NSC 4780 EINECS 211-087-1 UNII-9GPU7PGV1G BRN 1701629 dioxanone n hexyl ormate SCHEMBL59493 HEXYL FORMATE [FHFI] Hexyl formate, >=97%, FG CHEMBL2270391 DTXSID8060870 FEMA 2570 NSC4780 CHEBI:179998 MFCD00046146 AKOS015902384 MCULE-1329787181 LS-13342 DB-003683 H1271 NS00012608 Q3077504
Microorganism:	Yes
IUPAC name	hexyl formate
SMILES	CCCCCCOC=O
Inchi	InChI=1S/C7H14O2/c1-2-3-4-5-6-9-7-8/h7H,2-6H2,1H3
Formula	C7H14O2
PubChem ID	61177
Molweight	130.18
LogP	2.5
Atoms	9
Bonds	6
H-bond Acceptor	2
H-bond Donor	0
Chemical Classification	esters
CHEBI-ID	179998
Supernatural-ID	SN0275416

mVOC Specific Details

Boiling Point	Degree Reference 155 median
MS-Links	MS-MS Spectrum 149524 MS-MS Spectrum 87088 MS-MS Spectrum 149523 MS-MS Spectrum 149525 MS-MS Spectrum 87087 MS-MS Spectrum 87089
Massbank-Links	Massbank Spectrum MSBNK-Fac_Eng_Univ_Tokyo-JP006467

Species emitting the compound

Kingdom Species Biological Function Origin/Habitat Reference Eukaryota Aspergillus Flavus n/a NA Beck et al. 2012 Eukaryota Aspergillus Parasiticus n/a NA Beck et al. 2012 Eukaryota Aspergillus Niger n/a NA Beck et al. 2012 Eukaryota Penicillium Glabrum n/a NA Beck et al. 2012 Eukaryota Rhizopus Stolonifer n/a NA Beck et al. 2012 Eukaryota Fusarium Fujikuroi NA Studt et al. 2016 Prokaryota Carnobacterium Divergens n/a NA Ercolini et al. 2009 Cyberlindnera Fabianii Ma et al. 2023 Lactobacillus Plantarum Ma et al. 2023

Method

Kingdom Species Growth Medium Applied Method Verification Eukaryota Aspergillus Flavus potato dextrose agar and Polyunsaturated Fatty Acids SPME/ GC-MS no Eukaryota Aspergillus Parasiticus potato dextrose agar and Polyunsaturated Fatty Acids SPME/ GC-MS no Eukaryota Aspergillus Niger potato dextrose agar and Polyunsaturated Fatty Acids SPME/ GC-MS no Eukaryota Penicillium Glabrum potato dextrose agar and Polyunsaturated Fatty Acids SPME/ GC-MS no Eukaryota Rhizopus Stolonifer potato dextrose agar and Polyunsaturated Fatty Acids SPME/ GC-MS no Eukaryota Fusarium Fujikuroi no Prokaryota Carnobacterium Divergens n/a n/a no Cyberlindnera Fabianii tuna cooking liquid HS-SPME-GC/MS no Lactobacillus Plantarum tuna cooking liquid HS-SPME-GC/MS no