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Cyclohexaneacetic acid, .alpha.,.alpha.,1-trimethyl-, methyl ester
SpectraBase Compound ID 7LB8dMQpfJQ
InChI InChI=1S/C12H22O2/c1-11(2,10(13)14-4)12(3)8-6-5-7-9-12/h5-9H2,1-4H3
InChIKey AJYGFIDENCLUTH-UHFFFAOYSA-N
Mol Weight 198.31 g/mol
Molecular Formula C12H22O2
Exact Mass 198.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1mQsT7ddmph
Name Cyclohexaneacetic acid, .alpha.,.alpha.,1-trimethyl-, methyl ester
Alternate Name(s) Methyl 2-methyl-2-(1-methylcyclohexyl)propanoate Methylester of .alpha.,.alpha.,1-trimethyl-1-cyclohexylacetic acid
CAS Registry Number 88255-57-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O2
InChI InChI=1S/C12H22O2/c1-11(2,10(13)14-4)12(3)8-6-5-7-9-12/h5-9H2,1-4H3
InChIKey AJYGFIDENCLUTH-UHFFFAOYSA-N
Molecular Weight 198.306 g/mol
SMILES C(C(=O)OC)(C1(C)CCCCC1)(C)C
SPLASH splash10-0zfs-9500000000-b1a1d222a501438618b6
Source of Spectrum K-116-3717-0
Wiley ID 1195846