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1-Cyclohexene-1-carboxylic acid, 4-(1,1-dimethylethyl)-, methyl ester
SpectraBase Compound ID KtEMKJxV5FQ
InChI InChI=1S/C12H20O2/c1-12(2,3)10-7-5-9(6-8-10)11(13)14-4/h5,10H,6-8H2,1-4H3
InChIKey BSCDTCHUFJCJOL-UHFFFAOYSA-N
Mol Weight 196.29 g/mol
Molecular Formula C12H20O2
Exact Mass 196.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DSA7ny0rFEG
Name 1-Cyclohexene-1-carboxylic acid, 4-(1,1-dimethylethyl)-, methyl ester
Alternate Name(s) 4-tert-Butyl-1-cyclohexenecarboxylic acid methyl ester 4-tert-Butylcyclohexene-1-carboxylic acid methyl ester Methyl 4-tert-butyl-1-cyclohexene-1-carboxylate Methyl 4-tert-butylcyclohexene-1-carboxylate
CAS Registry Number 22173-19-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O2
InChI InChI=1S/C12H20O2/c1-12(2,3)10-7-5-9(6-8-10)11(13)14-4/h5,10H,6-8H2,1-4H3
InChIKey BSCDTCHUFJCJOL-UHFFFAOYSA-N
Molecular Weight 196.290 g/mol
SMILES C1(C(=O)OC)=CCC(C(C)(C)C)CC1
SPLASH splash10-0006-0900000000-0ed88df2d17fc3e130a8
Source of Spectrum AJ-60-1845-31
Wiley ID 1193655