Results for:
PubChem ID: 7714

5-heptyloxolan-2-one

Mass-Spectra

Compound Details

Synonymous names	Gamma-undecalactone 104-67-6 5-Heptyldihydrofuran-2(3H)-one 4-Undecanolide 2(3H)-Furanone, 5-heptyldihydro- Undecanoic gamma-lactone Undecan-4-olide Peach aldehyde 5-heptyloxolan-2-one Persicol 1,4-Undecanolide Peach lactone 5-Heptyldihydro-2(3H)-furanone Aldehyde C-14 peach gamma-Undecanolactone 4-Hydroxyundecanoic acid lactone .gamma.-Undecalactone FEMA No. 3091 Aldehyde C14 .gamma.-n-Heptylbutyrolactone NSC 406421 5-Heptyl-dihydro-furan-2-one .gamma.-Undecalatone .gamma.-Undecanolide 57084-17-0 xi-gamma-Undecalactone .gamma.-Undecanolactone MFCD00005405 QB1T0AG2YL .gamma.-Heptylbutyrolactone CHEMBL195827 DTXSID4034287 CHEBI:89362 5-Heptyl-dihydrofuran-2(3H)-one .gamma.-Heptyl-.gamma.-butyrolactone NSC-46118 NSC-76413 NSC-406421 4-Hydroxyundecanoic acid, .gamma.-lactone Undecanoic acid, 4-hydroxy-, .gamma.-lactone WLN: T5OVTJ E7 gamma-Undecanolide 1,4-Hendecanolide Undecanoic acid, .gamma.-lactone gamma-Heptyl-gamma-butyrolactone gamma-n-Heptylbutyrolactone gamma-Undekalakton gamma-Undekalakton [Czech] gamma-Undecalactone (natural) CCRIS 1425 EINECS 203-225-4 UNII-QB1T0AG2YL BRN 0081943 g-Undecalactone AI3-00751 Undecanoic acid, 4-hydroxy-, gamma-lactone Dihydro-5-heptyl-2(3H)-furanone Undecanolide-1,4 .gamma.-Undekalakton Undecanoic ?-lactone undecylene methyl lactone Undecanoic gamma -lactone GAMMA UNDECALACTONE UNDECALACTONE GAMMA Undecanoic .gamma.-lactone EC 203-225-4 SCHEMBL113498 Undecanoic gamma-lactone, 99% DTXCID2014287 PHXATPHONSXBIL-UHFFFAOYSA- 4- hydroxyundecanoic acid lactone GAMMA-UNDECALACTONE [FCC] GAMMA-UNDECALACTONE [INCI] HMS1786B22 (RS)-.GAMMA.-UNDECALACTONE NSC46118 NSC76413 5-Heptyldihydro-2(3H)-furanone # Tox21_300063 BDBM50168011 LMFA07040030 NSC406421 .GAMMA.-UNDECALACTONE [FHFI] AKOS001076126 (+/-)-.GAMMA.-UNDECALACTONE CS-W016994 HY-W016278 MCULE-9018416843 gamma-Undecalactone, analytical standard gamma-Undecalactone, >=98%, FCC, FG NCGC00164025-01 NCGC00164025-02 NCGC00254148-01 BS-14211 CAS-104-67-6 SY011229 DB-040554 NS00076562 U0003 EN300-05986 D70490 gamma-Undecalactone, natural (US), >=98%, FG J-001223 Q24734376 Z90120148 InChI=1/C11H20O2/c1-2-3-4-5-6-7-10-8-9-11(12)13-10/h10H,2-9H2,1H3
Microorganism:	Yes
IUPAC name	5-heptyloxolan-2-one
SMILES	CCCCCCCC1CCC(=O)O1
Inchi	InChI=1S/C11H20O2/c1-2-3-4-5-6-7-10-8-9-11(12)13-10/h10H,2-9H2,1H3
Formula	C11H20O2
PubChem ID	7714
Molweight	184.27
LogP	3.3
Atoms	13
Bonds	6
H-bond Acceptor	2
H-bond Donor	0
Chemical Classification	esters lactones
CHEBI-ID	10580
Supernatural-ID	SN0285884

mVOC Specific Details

MS-Links	MS-MS Spectrum 18157 MS-MS Spectrum 11485 MS-MS Spectrum 18155 MS-MS Spectrum 18156 MS-MS Spectrum 11484 MS-MS Spectrum 11483
Massbank-Links	Massbank Spectrum MSBNK-Fac_Eng_Univ_Tokyo-JP002881 Massbank Spectrum MSBNK-Fac_Eng_Univ_Tokyo-JP008312 Massbank Spectrum MSBNK-Fac_Eng_Univ_Tokyo-JP008731 Massbank Spectrum MSBNK-Fac_Eng_Univ_Tokyo-JP008909

Species emitting the compound

Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Dinoroseobacter Shibae n/a NA Dickschat et al. 2005_4 Prokaryota Stigmatella Sp. n/a NA Schulz and Dickschat 2007 Prokaryota Loktanella Sp. n/a NA Schulz and Dickschat 2007 Prokaryota Dinoroseobacter Sp. n/a NA Schulz and Dickschat 2007 Eukaryota Saccharomyces Cerevisiae NA NA Harris et al. 2021 Fusarium Graminearum Ballot et al. 2023

Method

Kingdom Species Growth Medium Applied Method Verification Prokaryota Dinoroseobacter Shibae n/a n/a no Prokaryota Stigmatella Sp. n/a n/a no Prokaryota Loktanella Sp. n/a n/a no Prokaryota Dinoroseobacter Sp. n/a n/a no Eukaryota Saccharomyces Cerevisiae malt extract broth HS-SPME with GC-MS no Fusarium Graminearum tryptone soy (TS medium; Carl Roth, Karlsruhe, Germany) GC-QQQ-MS no