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METHYL-13-HYDROXYOCTADECANOATE
SpectraBase Compound ID 4roMOKBMPut
InChI InChI=1S/C19H38O3/c1-3-4-12-15-18(20)16-13-10-8-6-5-7-9-11-14-17-19(21)22-2/h18,20H,3-17H2,1-2H3
InChIKey YVKGSGUFEPMJNM-UHFFFAOYSA-N
Mol Weight 314.5 g/mol
Molecular Formula C19H38O3
Exact Mass 314.282095 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DjHShYrekgQ
Name Octadecanoic acid, 13-hydroxy-, methyl ester
Alternate Name(s) Methyl 13-hydroxyoctadecanoate 13-hydroxystearic acid methyl ester Methyl 13-oxidanyloctadecanoate
CAS Registry Number 2540-76-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H38O3
InChI InChI=1S/C19H38O3/c1-3-4-12-15-18(20)16-13-10-8-6-5-7-9-11-14-17-19(21)22-2/h18,20H,3-17H2,1-2H3
InChIKey YVKGSGUFEPMJNM-UHFFFAOYSA-N
Molecular Weight 314.510 g/mol
SMILES OC(CCCCCCCCCCCC(OC)=O)CCCCC
SPLASH splash10-06z0-9010000000-8fc7f3dc25d88767f68e
Source of Spectrum Va-0-0-0
Wiley ID 741619