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Methyl isostearate
SpectraBase Compound ID KUN4wqLJixw
InChI InChI=1S/C19H38O2/c1-18(2)16-14-12-10-8-6-4-5-7-9-11-13-15-17-19(20)21-3/h18H,4-17H2,1-3H3
InChIKey KDQIFKKWPMBNOH-UHFFFAOYSA-N
Mol Weight 298.5 g/mol
Molecular Formula C19H38O2
Exact Mass 298.28718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GXk0fhxMKeW
Name 14-Methyl-heptadecanoic acid methyl ester
CAS Registry Number 2490-23-5
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 298.287180462 u
Formula C19H38O2
InChI InChI=1S/C19H38O2/c1-18(2)16-14-12-10-8-6-4-5-7-9-11-13-15-17-19(20)21-3/h18H,4-17H2,1-3H3
InChIKey KDQIFKKWPMBNOH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 298.511 g/mol
Nominal Mass 298 u
Quality 996
Retention Index 2091
SMILES C(CCCCCCCCCCCCCCC(C)C)(OC)=O
SPLASH splash10-059g-9330000000-a27d02e83a12cf50474e
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms methyl 16-methylheptadecanoate
Technique GC/MS
Wiley ID DD2024_002285