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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 GytVYDyKORh
Name Methyl isostearate
Alternate Name(s) Heptadecanoic acid, 16-methyl-, methyl ester 16-Methylheptadecanoic acid methyl ester Methyl 16-methylheptadecanoate
CAS Registry Number 5129-61-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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
Molecular Weight 298.511 g/mol
SMILES CC(C)CCCCCCCCCCCCCCC(=O)OC
SPLASH splash10-00g3-9110000000-6238522a72d89ebd5df7
Source of Spectrum AD-0-3297-0
Wiley ID 44198