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(2.alpha.,3.alpha.,4.alpha.,5.beta.)-(+-)-4-methyl 2-phenylmethyl 3-cyano-2-(diphenyl-phosphinoyl)-5-phenyl-2,4-pyrrolidinedicarboxylate

View entire compound with spectra: 1 MS (GC)

(2.alpha.,3.alpha.,4.alpha.,5.beta.)-(+-)-4-methyl 2-phenylmethyl 3-cyano-2-(diphenyl-phosphinoyl)-5-phenyl-2,4-pyrrolidinedicarboxylate
SpectraBase Compound ID DH0j5VIVi5e
InChI InChI=1S/C33H29N2O5P/c1-39-31(36)29-28(22-34)33(35-30(29)25-16-8-3-9-17-25,32(37)40-23-24-14-6-2-7-15-24)41(38,26-18-10-4-11-19-26)27-20-12-5-13-21-27/h2-21,28-30,35H,23H2,1H3/t28-,29+,30-,33-/m1/s1
InChIKey WDDHKTINAIVZMJ-NDQSGYKOSA-N
Mol Weight 564.6 g/mol
Molecular Formula C33H29N2O5P
Exact Mass 564.181409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BfqYxQ888tb
Name (2.alpha.,3.alpha.,4.alpha.,5.beta.)-(+-)-4-methyl 2-phenylmethyl 3-cyano-2-(diphenyl-phosphinoyl)-5-phenyl-2,4-pyrrolidinedicarboxylate
CAS Registry Number 127253-70-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H29N2O5P
InChI InChI=1S/C33H29N2O5P/c1-39-31(36)29-28(22-34)33(35-30(29)25-16-8-3-9-17-25,32(37)40-23-24-14-6-2-7-15-24)41(38,26-18-10-4-11-19-26)27-20-12-5-13-21-27/h2-21,28-30,35H,23H2,1H3/t28-,29+,30-,33-/m1/s1
InChIKey WDDHKTINAIVZMJ-NDQSGYKOSA-N
Molecular Weight 564.578 g/mol
SMILES N1[C@@]([C@]([C@]([C@@]1(P(=O)(c1ccccc1)c1ccccc1)C(OCc1ccccc1)=O)(C#N)[H])(C(=O)OC)[H])(c1ccccc1)[H]
SPLASH splash10-0006-9011000000-d4415f52995e5d69b620
Source of Spectrum J-55-4077-8
Wiley ID 1407153