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Octadecanoic acid, 9-methyl-, ethyl ester
SpectraBase Compound ID 35Sx0uazp3r
InChI InChI=1S/C21H42O2/c1-4-6-7-8-9-11-14-17-20(3)18-15-12-10-13-16-19-21(22)23-5-2/h20H,4-19H2,1-3H3
InChIKey ASCIHENARZDYFV-UHFFFAOYSA-N
Mol Weight 326.6 g/mol
Molecular Formula C21H42O2
Exact Mass 326.318481 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FYqoqSqARRs
Name Octadecanoic acid, 9-methyl-, ethyl ester
Alternate Name(s) Ethyl 9-methyloctadecanoate 9-Methyloctadecanoic acid ethyl ester 9-Methylstearic acid ethyl ester
CAS Registry Number 55334-34-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H42O2
InChI InChI=1S/C21H42O2/c1-4-6-7-8-9-11-14-17-20(3)18-15-12-10-13-16-19-21(22)23-5-2/h20H,4-19H2,1-3H3
InChIKey ASCIHENARZDYFV-UHFFFAOYSA-N
Molecular Weight 326.565 g/mol
SMILES C(CCCCCCCC(CCCCCCCCC)C)(=O)OCC
SPLASH splash10-0kbr-9503000000-f7b460c96761159d124c
Source of Spectrum JX-2015-6-5778
Wiley ID 1729235