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N-(5',5'-Dimethyl-3'-oxocyclohex-1'-enyl)-N-benzylpent-4-enamide
SpectraBase Compound ID CrxQ5h6rVWe
InChI InChI=1S/C20H25NO2/c1-4-5-11-19(23)21(15-16-9-7-6-8-10-16)17-12-18(22)14-20(2,3)13-17/h4,6-10,12H,1,5,11,13-15H2,2-3H3
InChIKey JMOKDAGYBJHOSS-UHFFFAOYSA-N
Mol Weight 311.43 g/mol
Molecular Formula C20H25NO2
Exact Mass 311.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LB9IprQO049
Name N-(5',5'-Dimethyl-3'-oxocyclohex-1'-enyl)-N-benzylpent-4-enamide
Comments Note: The molecular formula of the structure shown is C20H25NO2 - which differs from the formula reported for the mass spectrum (C18H21NO2)
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Formula C18H21NO2
InChI InChI=1S/C20H25NO2/c1-4-5-11-19(23)21(15-16-9-7-6-8-10-16)17-12-18(22)14-20(2,3)13-17/h4,6-10,12H,1,5,11,13-15H2,2-3H3
InChIKey JMOKDAGYBJHOSS-UHFFFAOYSA-N
Molecular Weight 311.425 g/mol
SMILES C(CCC=C)(=O)N(Cc1ccccc1)C1=CC(CC(C1)(C)C)=O
SPLASH splash10-052f-9100000000-45cac272f77260872bce
Source of Spectrum AC-133-632-9
Wiley ID 812222