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N-p-Methylphenyl-trans, trans-.alpha.-carboxyl-.beta.-methoxycarbonyl-.gamma.-phenyl-.gamma.-butyrolactam
SpectraBase Compound ID 8NBg8BvzVHt
InChI InChI=1S/C20H19NO5/c1-12-8-10-14(11-9-12)21-17(13-6-4-3-5-7-13)15(20(25)26-2)16(18(21)22)19(23)24/h3-11,15-17H,1-2H3,(H,23,24)/t15-,16-,17+/m0/s1
InChIKey LGYLMZNIXCXIQU-YESZJQIVSA-N
Mol Weight 353.37 g/mol
Molecular Formula C20H19NO5
Exact Mass 353.126323 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DWOWwOAlTdr
Name N-p-Methylphenyl-trans, trans-.alpha.-carboxyl-.beta.-methoxycarbonyl-.gamma.-phenyl-.gamma.-butyrolactam
Alternate Name(s) (3S,4S,5S)-4-(methoxycarbonyl)-2-oxo-5-phenyl-1-(p-tolyl)pyrrolidine-3-carboxylic acid (3S,4S,5S)-4-methoxycarbonyl-1-(4-methylphenyl)-2-oxo-5-phenyl-3-pyrrolidinecarboxylic acid (3S,4S,5S)-4-methoxycarbonyl-1-(4-methylphenyl)-2-oxo-5-phenylpyrrolidine-3-carboxylic acid (3S,4S,5S)-4-methoxycarbonyl-2-oxo-5-phenyl-1-(p-tolyl)pyrrolidine-3-carboxylic acid (3S,4S,5S)-4-methoxycarbonyl-1-(4-methylphenyl)-2-oxidanylidene-5-phenyl-pyrrolidine-3-carboxylic acid
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Formula C20H19NO5
InChI InChI=1S/C20H19NO5/c1-12-8-10-14(11-9-12)21-17(13-6-4-3-5-7-13)15(20(25)26-2)16(18(21)22)19(23)24/h3-11,15-17H,1-2H3,(H,23,24)/t15-,16-,17+/m0/s1
InChIKey LGYLMZNIXCXIQU-YESZJQIVSA-N
Literature Reference DOI 10.1002/cjoc.20010190919
Molecular Weight 353.374 g/mol
SMILES OC([C@]1([C@@]([C@](N(c2ccc(cc2)C)C1=O)(c1ccccc1)[H])(C(OC)=O)[H])[H])=O
SPLASH splash10-052e-2914000000-6c38a62de84b5e5dccdb
Source of Spectrum CJC-19-904-3b
Wiley ID 1773615