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DL-Proline, 3-cyano-2-(diphenylphosphinyl)-4,5-diphenyl-, phenylmethyl ester, (2.alpha.,3.beta.,4.alpha.,5.alpha.)-
SpectraBase Compound ID KFzEpsdaTZZ
InChI InChI=1S/C37H31N2O3P/c38-26-33-34(29-18-8-2-9-19-29)35(30-20-10-3-11-21-30)39-37(33,36(40)42-27-28-16-6-1-7-17-28)43(41,31-22-12-4-13-23-31)32-24-14-5-15-25-32/h1-25,33-35,39H,27H2/t33-,34-,35-,37-/m1/s1
InChIKey GSGVDVJCYUPWFQ-OEPYUYADSA-N
Mol Weight 582.6 g/mol
Molecular Formula C37H31N2O3P
Exact Mass 582.20723 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5utRweMpKbN
Name DL-Proline, 3-cyano-2-(diphenylphosphinyl)-4,5-diphenyl-, phenylmethyl ester, (2.alpha.,3.beta.,4.alpha.,5.alpha.)-
CAS Registry Number 127183-88-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C37H31N2O3P
InChI InChI=1S/C37H31N2O3P/c38-26-33-34(29-18-8-2-9-19-29)35(30-20-10-3-11-21-30)39-37(33,36(40)42-27-28-16-6-1-7-17-28)43(41,31-22-12-4-13-23-31)32-24-14-5-15-25-32/h1-25,33-35,39H,27H2/t33-,34-,35-,37-/m1/s1
InChIKey GSGVDVJCYUPWFQ-OEPYUYADSA-N
Molecular Weight 582.640 g/mol
SMILES N1[C@@]([C@@]([C@]([C@@]1(P(=O)(c1ccccc1)c1ccccc1)C(OCc1ccccc1)=O)(C#N)[H])(c1ccccc1)[H])(c1ccccc1)[H]
SPLASH splash10-0f95-9335000000-1d36e3583e1c859eb1f0
Source of Spectrum J-55-4078-17
Synonyms (2.alpha.,3.alpha.,4.beta.,5.beta.)-(+-)-Phenylmethyl 3-cyano-2-(diphenylphosphinoyl)-4,5-diphenyl-2-pyrrolidinecarboxylate benzyl (2R,3S,4S,5S)-3-cyano-2-(diphenylphosphoryl)-4,5-diphenyl-2-pyrrolidinecarboxylate
Wiley ID 1408701