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Methyl ricinoleate
SpectraBase Compound ID A9WJSDcAyjw
InChI InChI=1S/C19H36O3/c1-3-4-5-12-15-18(20)16-13-10-8-6-7-9-11-14-17-19(21)22-2/h10,13,18,20H,3-9,11-12,14-17H2,1-2H3/b13-10-/t18-/m1/s1
InChIKey XKGDWZQXVZSXAO-ADYSOMBNSA-N
Mol Weight 312.5 g/mol
Molecular Formula C19H36O3
Exact Mass 312.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2mvEaVzWe5w
Name Ricinoleic acid ME
Classification Omega-9 fatty acid
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 312.266445016 u
Formula C19H36O3
InChI InChI=1S/C19H36O3/c1-3-4-5-12-15-18(20)16-13-10-8-6-7-9-11-14-17-19(21)22-2/h10,13,18,20H,3-9,11-12,14-17H2,1-2H3/b13-10-/t18-/m1/s1
InChIKey XKGDWZQXVZSXAO-ADYSOMBNSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 312.494 g/mol
Nominal Mass 312 u
Quality 960
Retention Index 2188
SMILES O[C@@](C\C=C/CCCCCCCC(OC)=O)(CCCCCC)[H]
SPLASH splash10-0595-9200000000-7a9dc524b2526d7c0544
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms (9Z,12R)-12-Hydroxyoctadec-9-enoic acid
Technique GC/MS
Wiley ID DD2024_026410