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Octadecanoic acid, 8-methyl-, methyl ester
SpectraBase Compound ID FJZmaol4CXR
InChI InChI=1S/C20H40O2/c1-4-5-6-7-8-9-10-13-16-19(2)17-14-11-12-15-18-20(21)22-3/h19H,4-18H2,1-3H3
InChIKey BZTPGHYSIBNXQW-UHFFFAOYSA-N
Mol Weight 312.5 g/mol
Molecular Formula C20H40O2
Exact Mass 312.302831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1vKNhxOdK5r
Name Octadecanoic acid, 8-methyl-, methyl ester
Alternate Name(s) Methyl 8-methyloctadecanoate 8-Methyloctadecanoic acid methyl ester 8-Methylstearic acid methyl ester
CAS Registry Number 2490-20-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H40O2
InChI InChI=1S/C20H40O2/c1-4-5-6-7-8-9-10-13-16-19(2)17-14-11-12-15-18-20(21)22-3/h19H,4-18H2,1-3H3
InChIKey BZTPGHYSIBNXQW-UHFFFAOYSA-N
Molecular Weight 312.538 g/mol
SMILES C(C(CCCCCCCCCC)C)CCCCCC(OC)=O
SPLASH splash10-000f-9400000000-fdc83be64236502b2d72
Source of Spectrum AD-0-1922-0
Wiley ID 46555