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1H-Pyrrole-2-carboxylic acid, 1-[2-(diphenylphosphino)-2-phenylethyl]-
SpectraBase Compound ID KljmHhyNbYP
InChI InChI=1S/C25H22NO2P/c27-25(28)23-17-10-18-26(23)19-24(20-11-4-1-5-12-20)29(21-13-6-2-7-14-21)22-15-8-3-9-16-22/h1-18,24H,19H2,(H,27,28)
InChIKey PLWYSYRJDZOBKG-UHFFFAOYSA-N
Mol Weight 399.43 g/mol
Molecular Formula C25H22NO2P
Exact Mass 399.138816 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1ZFYx9WUFbz
Name 1H-Pyrrole-2-carboxylic acid, 1-[2-(diphenylphosphino)-2-phenylethyl]-
CAS Registry Number 90909-80-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H22NO2P
InChI InChI=1S/C25H22NO2P/c27-25(28)23-17-10-18-26(23)19-24(20-11-4-1-5-12-20)29(21-13-6-2-7-14-21)22-15-8-3-9-16-22/h1-18,24H,19H2,(H,27,28)
InChIKey PLWYSYRJDZOBKG-UHFFFAOYSA-N
Molecular Weight 399.430 g/mol
SMILES OC(c1[n](CC(P(c2ccccc2)c2ccccc2)c2ccccc2)ccc1)=O
SPLASH splash10-0udi-0009000000-b2ec0d509f7344a56d89
Source of Spectrum K-117-1432-0
Synonyms 1-[2-(diphenylphosphino)-2-phenylethyl]-1H-pyrrole-2-carboxylic acid 1-[2-(diphenylphosphinyl)-2-phenylethyl]-2-pyrrole carbonic acid
Wiley ID 1369092