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Isobutyl 1,6-dimethyl-3-oxocyclohexene-6-carboxylate
SpectraBase Compound ID FYL8aGwZwbY
InChI InChI=1S/C13H20O3/c1-9(2)8-16-12(15)13(4)6-5-11(14)7-10(13)3/h7,9H,5-6,8H2,1-4H3
InChIKey FFYJZIHVXNXAJZ-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 9YnnJ7JSWE9
Name Isobutyl 1,6-dimethyl-3-oxocyclohexene-6-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-9(2)8-16-12(15)13(4)6-5-11(14)7-10(13)3/h7,9H,5-6,8H2,1-4H3
InChIKey FFYJZIHVXNXAJZ-UHFFFAOYSA-N
Molecular Weight 224.300 g/mol
SMILES C1(C(=CC(CC1)=O)C)(C(OCC(C)C)=O)C
SPLASH splash10-0ab9-9810000000-4495611dbe04b62b5bb6
Source of Spectrum QE-7-1025-6
Synonyms (R)-Isobutyl 1,6-dimethyl-3-oxocyclohexene-6-carboxylate isobutyl 1,2-dimethyl-4-oxo-2-cyclohexene-1-carboxylate
Wiley ID 845466