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1-Allyl-6-keto-2,2-dimethyl-cyclohexanecarboxylic acid methyl ester
SpectraBase Compound ID 5zBqOHxbO9I
InChI InChI=1S/C13H20O3/c1-5-8-13(11(15)16-4)10(14)7-6-9-12(13,2)3/h5H,1,6-9H2,2-4H3
InChIKey DNLWJNZNYVTRBB-UHFFFAOYSA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DoBScBL8QAl
Name 1-Allyl-6-keto-2,2-dimethyl-cyclohexanecarboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-5-8-13(11(15)16-4)10(14)7-6-9-12(13,2)3/h5H,1,6-9H2,2-4H3
InChIKey DNLWJNZNYVTRBB-UHFFFAOYSA-N
Molecular Weight 224.300 g/mol
SMILES C1(C(=O)OC)(C(CCCC1=O)(C)C)CC=C
SPLASH splash10-0006-9310000000-8ca8b9b415f1fd15fae2
Source of Spectrum J-56-3106-20
Synonyms 2,2-Dimethyl-6-oxo-1-prop-2-enyl-1-cyclohexanecarboxylic acid methyl ester Methyl 1-allyl-2,2-dimethyl-6-oxo-cyclohexanecarboxylate Methyl 2,2-dimethyl-6-oxidanylidene-1-prop-2-enyl-cyclohexane-1-carboxylate Methyl 2,2-dimethyl-6-oxo-1-prop-2-enylcyclohexane-1-carboxylate
Wiley ID 1225351