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Cyclohexaneoctanoic acid, 2-butyl-, methyl ester
SpectraBase Compound ID D0SfvisVDjY
InChI InChI=1S/C19H36O2/c1-3-4-12-17-14-10-11-15-18(17)13-8-6-5-7-9-16-19(20)21-2/h17-18H,3-16H2,1-2H3
InChIKey MCPUIPZASRSCFE-UHFFFAOYSA-N
Mol Weight 296.5 g/mol
Molecular Formula C19H36O2
Exact Mass 296.27153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2DcRsM85uy
Name Cyclohexaneoctanoic acid, 2-butyl-, methyl ester
CAS Registry Number 16847-05-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H36O2
InChI InChI=1S/C19H36O2/c1-3-4-12-17-14-10-11-15-18(17)13-8-6-5-7-9-16-19(20)21-2/h17-18H,3-16H2,1-2H3
InChIKey MCPUIPZASRSCFE-UHFFFAOYSA-N
Molecular Weight 296.495 g/mol
SMILES C(CC1C(CCCC)CCCC1)CCCCCC(OC)=O
SPLASH splash10-00l6-9000000000-5556f7a969f219e21cbb
Source of Spectrum T-66-1733-0
Synonyms Methyl 8-(2-butylcyclohexyl)octanoate 8-(2-butylcyclohexyl)caprylic acid methyl ester 8-(2-butylcyclohexyl)octanoic acid methyl ester
Wiley ID 1299613