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syn-8,8-dimethyl-7-oxobicyclo[2.2.2]oct-5-en-2yl acetate
SpectraBase Compound ID EgeEQQ2qXLL
InChI InChI=1S/C12H16O3/c1-7(13)15-10-6-8-4-5-9(10)11(14)12(8,2)3/h4-5,8-10H,6H2,1-3H3
InChIKey FFGDTFRSDHPBAP-UHFFFAOYSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7mWg8WfCYYS
Name syn-8,8-dimethyl-7-oxobicyclo[2.2.2]oct-5-en-2yl acetate
Alternate Name(s) anti-8,8-dimethyl-7-oxobicyclo[2.2.2]oct-5-en-2-yl acetate 8,8-Dimethyl-7-oxobicyclo[2.2.2]oct-5-en-2-yl acetate
CAS Registry Number 125075-27-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-7(13)15-10-6-8-4-5-9(10)11(14)12(8,2)3/h4-5,8-10H,6H2,1-3H3
InChIKey FFGDTFRSDHPBAP-UHFFFAOYSA-N
Molecular Weight 208.257 g/mol
SMILES C1(C2C(OC(=O)C)CC(C1(C)C)C=C2)=O
SPLASH splash10-002f-9100000000-a4010d81932a58ced182
Source of Spectrum H-72-809-4
Wiley ID 1206889