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2-Butenedioic acid, 2-[2-amino-1-(N-benzoyl-P,P-diphenylphosphinimyl)-2-cyclohexylethenyl]-, dimethyl ester, (Z,Z)-
SpectraBase Compound ID 2wmPIaZVUgM
InChI InChI=1S/C33H35N2O5P/c1-39-29(36)23-28(33(38)40-2)31(30(34)24-15-7-3-8-16-24)41(26-19-11-5-12-20-26,27-21-13-6-14-22-27)35-32(37)25-17-9-4-10-18-25/h4-6,9-14,17-24H,3,7-8,15-16,34H2,1-2H3/b28-23-,31-30-
InChIKey ROMDQBVDAVMOQP-WGDUTUNQSA-N
Mol Weight 570.6 g/mol
Molecular Formula C33H35N2O5P
Exact Mass 570.228359 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 69vaSSUgJPg
Name 2-Butenedioic acid, 2-[2-amino-1-(N-benzoyl-P,P-diphenylphosphinimyl)-2-cyclohexylethenyl]-, dimethyl ester, (Z,Z)-
CAS Registry Number 126574-30-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H35N2O5P
InChI InChI=1S/C33H35N2O5P/c1-39-29(36)23-28(33(38)40-2)31(30(34)24-15-7-3-8-16-24)41(26-19-11-5-12-20-26,27-21-13-6-14-22-27)35-32(37)25-17-9-4-10-18-25/h4-6,9-14,17-24H,3,7-8,15-16,34H2,1-2H3/b28-23-,31-30-
InChIKey ROMDQBVDAVMOQP-WGDUTUNQSA-N
Molecular Weight 570.626 g/mol
SMILES N\C(=C\(\C(=C\C(=O)OC)C(=O)OC)P(=NC(=O)c1ccccc1)(c1ccccc1)c1ccccc1)C1CCCCC1
SPLASH splash10-0pb9-0985120000-486cfb874889956e448a
Source of Spectrum KC-1989-2276-9
Synonyms 1-Benzoyl-3-[1,2-bis(methyoxycarbonyl)vinyl]-4-cyclohexyl-2,2-diphenyl-1,5-diaza-2.lambda.(5)-phosphapenta-1,3-diene Dimethyl (2E)-2-{(Z)-2-amino-1-[benzoyl(diphenyl)phosphorimidoyl]-2-cyclohexylethenyl}-2-butenedioate
Wiley ID 1407718