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Diethyl (3R,4R,5S)-4-Formyl-3-phenyl-5-(2-tolyl)pyrrolidine-2,2-dicarboxylate
SpectraBase Compound ID FYUqWlWmhBc
InChI InChI=1S/C24H27NO5/c1-4-29-22(27)24(23(28)30-5-2)20(17-12-7-6-8-13-17)19(15-26)21(25-24)18-14-10-9-11-16(18)3/h6-15,19-21,25H,4-5H2,1-3H3/t19-,20-,21-/m1/s1
InChIKey KPWPSECVHJDYED-NJDAHSKKSA-N
Mol Weight 409.48 g/mol
Molecular Formula C24H27NO5
Exact Mass 409.188923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8u6kGTCAaSY
Name Diethyl (3R,4R,5S)-4-Formyl-3-phenyl-5-(2-tolyl)pyrrolidine-2,2-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H27NO5
InChI InChI=1S/C24H27NO5/c1-4-29-22(27)24(23(28)30-5-2)20(17-12-7-6-8-13-17)19(15-26)21(25-24)18-14-10-9-11-16(18)3/h6-15,19-21,25H,4-5H2,1-3H3/t19-,20-,21-/m1/s1
InChIKey KPWPSECVHJDYED-NJDAHSKKSA-N
Molecular Weight 409.482 g/mol
SMILES N1[C@@]([C@@]([C@](C1(C(=O)OCC)C(=O)OCC)(c1ccccc1)[H])(C=O)[H])(c1c(C)cccc1)[H]
SPLASH splash10-014i-0229000000-54232dbaa2055dbd4f4e
Source of Spectrum F4-45-2674-4i
Synonyms Diethyl (3S,4R,5S)-4-Formyl-3-phenyl-5-(2-tolyl)pyrrolidine-2,2-dicarboxylate (3S,4R,5S)-diethyl 4-formyl-3-phenyl-5-(o-tolyl)pyrrolidine-2,2-dicarboxylate
Wiley ID 1737172