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4-(2-Carbothoxy-2,2-dimethyl-ethyl)-5,5-dimethyl-cyclohex-3-ene-1-one
SpectraBase Compound ID EQfePFDyjOd
InChI InChI=1S/C15H24O3/c1-6-18-13(17)15(4,5)9-11-7-8-12(16)10-14(11,2)3/h7-8,11H,6,9-10H2,1-5H3
InChIKey AWMFNGBAQGKGPN-UHFFFAOYSA-N
Mol Weight 252.35 g/mol
Molecular Formula C15H24O3
Exact Mass 252.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LnWMPznzJxE
Name 4-(2-Carbothoxy-2,2-dimethyl-ethyl)-5,5-dimethyl-cyclohex-3-ene-1-one
Alternate Name(s) Ethyl 3-(6,6-dimethyl-4-oxo-2-cyclohexen-1-yl)-2,2-dimethylpropanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O3
InChI InChI=1S/C15H24O3/c1-6-18-13(17)15(4,5)9-11-7-8-12(16)10-14(11,2)3/h7-8,11H,6,9-10H2,1-5H3
InChIKey AWMFNGBAQGKGPN-UHFFFAOYSA-N
Molecular Weight 252.354 g/mol
SMILES C1(C(C=CC(C1)=O)CC(C(=O)OCC)(C)C)(C)C
SPLASH splash10-03fr-4920000000-a35e982e022fd8078703
Source of Spectrum IC-698-0-0
Wiley ID 1255790