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Ethyl esters of cis- and trans-4-(1,1-dimethylethyl)-1-ethenylcyclohexaneacetic acid
SpectraBase Compound ID 8m5RQaTyFZk
InChI InChI=1S/C16H28O2/c1-6-16(12-14(17)18-7-2)10-8-13(9-11-16)15(3,4)5/h6,13H,1,7-12H2,2-5H3
InChIKey MFAVKRCJEKKSKE-UHFFFAOYSA-N
Mol Weight 252.4 g/mol
Molecular Formula C16H28O2
Exact Mass 252.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DTMVb5nTUHo
Name Ethyl esters of cis- and trans-4-(1,1-dimethylethyl)-1-ethenylcyclohexaneacetic acid
CAS Registry Number 53188-54-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28O2
InChI InChI=1S/C16H28O2/c1-6-16(12-14(17)18-7-2)10-8-13(9-11-16)15(3,4)5/h6,13H,1,7-12H2,2-5H3
InChIKey MFAVKRCJEKKSKE-UHFFFAOYSA-N
Molecular Weight 252.398 g/mol
SMILES C1(C=C)(CC(=O)OCC)CCC(C(C)(C)C)CC1
SPLASH splash10-0abd-6900000000-a8ad06b74ad1036f10ca
Source of Spectrum J-40-89-0
Synonyms 1(ax)-Vinyl-1(eq)-[(ethoxycarbonyl)methyl-4(eq)-(t-butyl)cyclohexane Ethyl (4-tert-butyl-1-vinylcyclohexyl)acetate
Wiley ID 1256117