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[5,5-dimethyl-6-(3-oxobut-1-enyl)cyclohexen-1-yl]methyl acetate
SpectraBase Compound ID ET4b5LSr3xx
InChI InChI=1S/C15H22O3/c1-11(16)7-8-14-13(10-18-12(2)17)6-5-9-15(14,3)4/h6-8,14H,5,9-10H2,1-4H3
InChIKey FYKNKUGDCQFTMF-UHFFFAOYSA-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 EJOyrpBNF6Y
Name [5,5-dimethyl-6-(3-oxobut-1-enyl)cyclohexen-1-yl]methyl acetate
Alternate Name(s) (5,5-dimethyl-6-(3-oxobut-1-en-1-yl)cyclohex-1-en-1-yl)methyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O3
InChI InChI=1S/C15H22O3/c1-11(16)7-8-14-13(10-18-12(2)17)6-5-9-15(14,3)4/h6-8,14H,5,9-10H2,1-4H3
InChIKey FYKNKUGDCQFTMF-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ajoc.201700337
Molecular Weight 250.338 g/mol
SMILES C1C(C(C(=CC1)COC(=O)C)C=CC(C)=O)(C)C
SPLASH splash10-005d-1900000000-89ecdb177b6a38a6c380
Source of Spectrum AJO-6-1633-6
Wiley ID 1812994