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Dimethyl 4,5-trans-2,5-diphenylpyrrolin-3,4-dicarboxylate
SpectraBase Compound ID LhETkySGTNB
InChI InChI=1S/C20H19NO4/c1-24-19(22)15-16(20(23)25-2)18(14-11-7-4-8-12-14)21-17(15)13-9-5-3-6-10-13/h3-12,15,17,21H,1-2H3/t15-,17+/m0/s1
InChIKey FBPXUISEMRBUBX-DOTOQJQBSA-N
Mol Weight 337.38 g/mol
Molecular Formula C20H19NO4
Exact Mass 337.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID PMhsa9F30P
Name Dimethyl 4,5-trans-2,5-diphenylpyrrolin-3,4-dicarboxylate
Alternate Name(s) Dimethyl (2S,3S)-2,5-diphenyl-2,3-dihydro-1H-pyrrole-3,4-dicarboxylate
CAS Registry Number 41414-09-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19NO4
InChI InChI=1S/C20H19NO4/c1-24-19(22)15-16(20(23)25-2)18(14-11-7-4-8-12-14)21-17(15)13-9-5-3-6-10-13/h3-12,15,17,21H,1-2H3/t15-,17+/m0/s1
InChIKey FBPXUISEMRBUBX-DOTOQJQBSA-N
Molecular Weight 337.375 g/mol
SMILES N1[C@@]([C@](C(=C1c1ccccc1)C(=O)OC)(C(=O)OC)[H])(c1ccccc1)[H]
SPLASH splash10-004i-0392000000-92eb01130740eeab3aaa
Source of Spectrum AJ-59-1821-46
Wiley ID 1333176