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Methyl 2-propylhexadecanoate
SpectraBase Compound ID G909YmtFIgH
InChI InChI=1S/C20H40O2/c1-4-6-7-8-9-10-11-12-13-14-15-16-18-19(17-5-2)20(21)22-3/h19H,4-18H2,1-3H3
InChIKey CEQFOPGJYSVALV-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 9kIY3NZHBOZ
Name Methyl 2-propylhexadecanoate
Alternate Name(s) 2-Propylhexadecanoic acid methyl ester 2-Propylpalmitic acid methyl ester Hexadecanoic acid, 2-propyl-, methyl ester
CAS Registry Number 77828-58-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H40O2
InChI InChI=1S/C20H40O2/c1-4-6-7-8-9-10-11-12-13-14-15-16-18-19(17-5-2)20(21)22-3/h19H,4-18H2,1-3H3
InChIKey CEQFOPGJYSVALV-UHFFFAOYSA-N
Molecular Weight 312.538 g/mol
SMILES C(CCCCCC(C(=O)OC)CCC)CCCCCCCC
SPLASH splash10-066u-9500000000-19b428905585ce9b1443
Source of Spectrum W5-0-0-0
Wiley ID 1313791