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2-Butanone, 4-[5-(acetyloxy)-2,2-dimethyl-6-methylenecyclohexylidene]-, (E)-(.+-.)-
SpectraBase Compound ID H6mA1iDwK58
InChI InChI=1S/C15H22O3/c1-10(16)6-7-13-11(2)14(18-12(3)17)8-9-15(13,4)5/h7,14H,2,6,8-9H2,1,3-5H3/b13-7-
InChIKey HVSHHDHHAKRGHT-QPEQYQDCSA-N
Mol Weight 250.34 g/mol
Molecular Formula C15H22O3
Exact Mass 250.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KnCVtVaagEx
Name 2-Butanone, 4-[5-(acetyloxy)-2,2-dimethyl-6-methylenecyclohexylidene]-, (E)-(.+-.)-
CAS Registry Number 97306-47-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O3
InChI InChI=1S/C15H22O3/c1-10(16)6-7-13-11(2)14(18-12(3)17)8-9-15(13,4)5/h7,14H,2,6,8-9H2,1,3-5H3/b13-7-
InChIKey HVSHHDHHAKRGHT-QPEQYQDCSA-N
Molecular Weight 250.338 g/mol
SMILES C1(\C(C(CCC1OC(=O)C)(C)C)=C\CC(=O)C)=C
SPLASH splash10-0006-6900000000-17266c3c1e1d93c8d876
Source of Spectrum H-68-201-11
Synonyms (3E)-4,4-dimethyl-2-methylene-3-(3-oxobutylidene)cyclohexyl acetate 4,4-Dimethyl-2-methylidene-3-(3'-oxobutylidene)cyclohexyl acetate
Wiley ID 1253646