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Ethyl 2-(1,2-dimethyl-6-methylene-3-oxocyclohexyl)acetate
SpectraBase Compound ID 3KcvirLNbuv
InChI InChI=1S/C13H20O3/c1-5-16-12(15)8-13(4)9(2)6-7-11(14)10(13)3/h10H,2,5-8H2,1,3-4H3/t10?,13-/m1/s1
InChIKey JENMGVQANKXXQF-JLOHTSLTSA-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 iKuKm1BNFm
Name Ethyl 2-(1,2-dimethyl-6-methylene-3-oxocyclohexyl)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-5-16-12(15)8-13(4)9(2)6-7-11(14)10(13)3/h10H,2,5-8H2,1,3-4H3/t10?,13-/m1/s1
InChIKey JENMGVQANKXXQF-JLOHTSLTSA-N
Molecular Weight 224.300 g/mol
SMILES [C@@]1(C(CCC(C1C)=O)=C)(CC(=O)OCC)C
SPLASH splash10-000i-1900000000-ab2ee80bc25d436bd840
Source of Spectrum KC-0-1269-22
Synonyms ((S)-1,2-Dimethyl-6-methylene-3-oxo-cyclohexyl)-acetic acid ethyl ester Ethyl (1,2-dimethyl-6-methylene-3-oxocyclohexyl)acetate 2-[(1S)-1,2-dimethyl-6-methylene-3-oxocyclohexyl]acetic acid ethyl ester Ethyl 2-[(1S)-1,2-dimethyl-6-methylidene-3-oxocyclohexyl]acetate Ethyl 2-[(1S)-1,2-dimethyl-6-methylene-3-oxo-cyclohexyl]acetate Ethyl 2-[(1S)-1,2-dimethyl-6-methylidene-3-oxidanylidene-cyclohexyl]ethanoate
Wiley ID 828020