Results for:
PubChem ID: 13849

Pentadecanoic Acid

Mass-Spectra

Compound Details

Synonymous names	PENTADECANOIC ACID 1002-84-2 Pentadecylic acid n-Pentadecanoic acid Pentadecyclic acid n-Pentadecylic acid NSC 28486 C15:0 MFCD00002745 Pentadecanoic acid, 99% 2,2-DIDEUTEROPENTADECANOIC ACID CCW02D961F CHEMBL460025 DTXSID2021652 CHEBI:42504 64118-45-2 NSC-28486 F15 EINECS 213-693-1 BRN 1773831 UNII-CCW02D961F Pentadecyclate n-Pentadecylate AI3-36441 n-Pentadecanoate pentadecanoic'acid n-Pentadecanoicacid pentadecansäure tetradecylcarboxylic acid tetradecyl carboxylic acid bmse000558 SCHEMBL6311 Pentadecanoic acid, >=99% 4-02-00-01147 (Beilstein Handbook Reference) WLN: QV14 DTXCID601652 FA 15:0a FEMA NO. 4334 AMY5935 PENTADECANOIC ACID [FHFI] NSC28486 Tox21_201197 BDBM50242348 LMFA01010015 s6234 STL453783 AKOS015903762 CS-W004283 FA 15:0 HY-W004283 MCULE-3630464562 Pentadecanoic acid, analytical standard NCGC00248954-01 NCGC00258749-01 AS-57005 BP-27916 SY009985 CAS-1002-84-2 Pentadecanoic acid, ~99% (capillary GC) DB-343938 NS00015703 P0035 EN300-176407 H10804 Pentadecanoic acid; n-Caprylic Acid Sodium Salt 9B1C70C0-EF6E-4FCF-A3D3-DACCDCCF791C A897509 Q418951 J-000083
Microorganism:	Yes
IUPAC name	pentadecanoic acid
SMILES	CCCCCCCCCCCCCCC(=O)O
Inchi	InChI=1S/C15H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(16)17/h2-14H2,1H3,(H,16,17)
Formula	C15H30O2
PubChem ID	13849
Molweight	242.4
LogP	5.8
Atoms	17
Bonds	13
H-bond Acceptor	2
H-bond Donor	1
Chemical Classification	acids carboxylic acids organic acids
CHEBI-ID	42504
Supernatural-ID	SN0417048

mVOC Specific Details

MS-Links	MS-MS Spectrum 204919 MS-MS Spectrum 44596 MS-MS Spectrum 146247 MS-MS Spectrum 146248 MS-MS Spectrum 146249 MS-MS Spectrum 204923 MS-MS Spectrum 204920 MS-MS Spectrum 204918 MS-MS Spectrum 204922 MS-MS Spectrum 44595 MS-MS Spectrum 204921 MS-MS Spectrum 44597
MS-Links	GC-MS Spectrum 1684 - GC-MS (1 TMS)
1D-NMR-Links	1D NMR Spectrum 1557 - Varian 500 MHz 1H NMR 1D NMR Spectrum 2066 - JEOL 90 MHz 1H NMR 1D NMR Spectrum 2756 - Varian 25.16 MHz 13C NMR
Massbank-Links	Massbank Spectrum MSBNK-BGC_Munich-RP024801 Massbank Spectrum MSBNK-BGC_Munich-RP024802 Massbank Spectrum MSBNK-BGC_Munich-RP024803 Massbank Spectrum MSBNK-BS-BS003872 Massbank Spectrum MSBNK-BS-BS003873 Massbank Spectrum MSBNK-BS-BS003874 Massbank Spectrum MSBNK-BS-BS003875

Species emitting the compound

Kingdom Species Biological Function Origin/Habitat Reference Eukaryota Ganoderma Lucidum na saprophytic on deciduous trees Campos Ziegenbein et al. 2006 Eukaryota Spongiporus Leucomallellus na saprophytic mostly on wet, old pines Campos Ziegenbein et al. 2006 Prokaryota Streptomycetes Sp. n/a NA Stritzke et al. 2004 Eukaryota Pleurotus Eryngii na na Usami et al. 2014 Bacillus Acidiproducens Koilybayeva et al. 2023

Method

Kingdom Species Growth Medium Applied Method Verification Eukaryota Ganoderma Lucidum na GC/MS no Eukaryota Spongiporus Leucomallellus na GC/MS no Prokaryota Streptomycetes Sp. n/a n/a no Eukaryota Pleurotus Eryngii na GC/MS, GC-O, AEDA no Bacillus Acidiproducens bacteriological agar (BA, 15 g/L), gelatin peptone (GP, 5 g/L), and meat extract (ME, 3 g/L) GC–MS no