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(2R,5S)-5-(4-nitrophenyl)-2-phenyl-3-pyrroline-2,4-dicarboxylic acid dimethyl ester
SpectraBase Compound ID EVfatQMkroF
InChI InChI=1S/C20H18N2O6/c1-27-18(23)16-12-20(19(24)28-2,14-6-4-3-5-7-14)21-17(16)13-8-10-15(11-9-13)22(25)26/h3-12,17,21H,1-2H3/t17-,20+/m0/s1
InChIKey YINJTVAYYKWTGJ-FXAWDEMLSA-N
Mol Weight 382.37 g/mol
Molecular Formula C20H18N2O6
Exact Mass 382.116486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID COJCnVHTh1V
Name (2R,5S)-5-(4-nitrophenyl)-2-phenyl-3-pyrroline-2,4-dicarboxylic acid dimethyl ester
CAS Registry Number 131786-05-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18N2O6
InChI InChI=1S/C20H18N2O6/c1-27-18(23)16-12-20(19(24)28-2,14-6-4-3-5-7-14)21-17(16)13-8-10-15(11-9-13)22(25)26/h3-12,17,21H,1-2H3/t17-,20+/m0/s1
InChIKey YINJTVAYYKWTGJ-FXAWDEMLSA-N
Molecular Weight 382.372 g/mol
SMILES N1[C@@](C=C([C@@]1(c1ccc(N(=O)=O)cc1)[H])C(=O)OC)(C(=O)OC)c1ccccc1
SPLASH splash10-00dl-0097000000-093b4a267580775180ab
Source of Spectrum F-46-6476-4
Synonyms (2S,5R)-2-(4-nitrophenyl)-5-phenyl-1,2-dihydropyrrole-3,5-dicarboxylic acid dimethyl ester Dimethyl (2S,5R)-2-(4-nitrophenyl)-5-phenyl-1,2-dihydropyrrole-3,5-dicarboxylate
Wiley ID 1360492