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Dimethyl 4,5-cis-2-phenyl-5-(2-phenylethenyl)pyrrolin-3,4-dicarboxylate
SpectraBase Compound ID 94Ueno6WCbM
InChI InChI=1S/C22H21NO4/c1-26-21(24)18-17(14-13-15-9-5-3-6-10-15)23-20(19(18)22(25)27-2)16-11-7-4-8-12-16/h3-14,17-18,23H,1-2H3/b14-13+/t17-,18+/m1/s1
InChIKey UMMFXYFGQDKTQL-JUWLWVHDSA-N
Mol Weight 363.41 g/mol
Molecular Formula C22H21NO4
Exact Mass 363.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7zXPFhmNg0e
Name Dimethyl 4,5-cis-2-phenyl-5-(2-phenylethenyl)pyrrolin-3,4-dicarboxylate
Alternate Name(s) Dimethyl (2R,3R)-5-phenyl-2-[(E)-2-phenylethenyl]-2,3-dihydro-1H-pyrrole-3,4-dicarboxylate
CAS Registry Number 107554-71-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21NO4
InChI InChI=1S/C22H21NO4/c1-26-21(24)18-17(14-13-15-9-5-3-6-10-15)23-20(19(18)22(25)27-2)16-11-7-4-8-12-16/h3-14,17-18,23H,1-2H3/b14-13+/t17-,18+/m1/s1
InChIKey UMMFXYFGQDKTQL-JUWLWVHDSA-N
Molecular Weight 363.413 g/mol
SMILES N1[C@@]([C@@](C(=C1c1ccccc1)C(=O)OC)(C(=O)OC)[H])(\C=C\c1ccccc1)[H]
SPLASH splash10-0i6r-0749000000-5dbd3577266efc5e71e3
Source of Spectrum AJ-59-1822-48
Wiley ID 1350320