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5,5-Dimethyl-3-[2'-(methoxyethenyl)]cyclohex-2-en-1-one
SpectraBase Compound ID JDeqzC68rPw
InChI InChI=1S/C11H16O2/c1-11(2)7-9(4-5-13-3)6-10(12)8-11/h4-6H,7-8H2,1-3H3/b5-4+
InChIKey LXMWPSIVZABZJC-SNAWJCMRSA-N
Mol Weight 180.25 g/mol
Molecular Formula C11H16O2
Exact Mass 180.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5sNk7Z1J1cG
Name 5,5-Dimethyl-3-[2'-(methoxyethenyl)]cyclohex-2-en-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C11H16O2
InChI InChI=1S/C11H16O2/c1-11(2)7-9(4-5-13-3)6-10(12)8-11/h4-6H,7-8H2,1-3H3/b5-4+
InChIKey LXMWPSIVZABZJC-SNAWJCMRSA-N
Molecular Weight 180.247 g/mol
SMILES C1(=CC(=O)CC(C1)(C)C)\C=C\OC
SPLASH splash10-001i-0900000000-a78d92e38c67cecfc2f1
Source of Spectrum B-51-520-15
Synonyms 3-[(E)-2-methoxyethenyl]-5,5-dimethyl-2-cyclohexen-1-one
Wiley ID 746074