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METHYL-2-(N-BENZYLANILINO)-4-OXOCYCLOHEX-2-EN-CARBOXYLATE
SpectraBase Compound ID EvWLDx3lVcH
InChI InChI=1S/C21H21NO3/c1-25-21(24)19-13-12-18(23)14-20(19)22(17-10-6-3-7-11-17)15-16-8-4-2-5-9-16/h2-11,14,19H,12-13,15H2,1H3
InChIKey GTCFONPQXUZGNO-UHFFFAOYSA-N
Mol Weight 335.4 g/mol
Molecular Formula C21H21NO3
Exact Mass 335.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1pqh7W3BdOo
Name Methyl 2-(N-benzylanilino)-4-oxocyclohex-2-ene-1-carboxylate
Alternate Name(s) 2-(N-benzylanilino)-4-keto-cyclohex-2-ene-1-carboxylic acid methyl ester 4-Oxo-2-(N-(phenylmethyl)anilino)-1-cyclohex-2-enecarboxylic acid methyl ester Methyl 4-oxidanylidene-2-[phenyl-(phenylmethyl)amino]cyclohex-2-ene-1-carboxylate
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Formula C21H21NO3
InChI InChI=1S/C21H21NO3/c1-25-21(24)19-13-12-18(23)14-20(19)22(17-10-6-3-7-11-17)15-16-8-4-2-5-9-16/h2-11,14,19H,12-13,15H2,1H3
InChIKey GTCFONPQXUZGNO-UHFFFAOYSA-N
Molecular Weight 335.403 g/mol
SMILES C=1(C(C(=O)OC)CCC(C1)=O)N(Cc1ccccc1)c1ccccc1
SPLASH splash10-00kf-6019000000-3197777ed5c103e51e48
Source of Spectrum AC-1994-70-5
Wiley ID 811763