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Benzoic acid, 2-[[2-[(triphenylphosphoranylidene)amino]benzoyl]amino]-, methyl ester
SpectraBase Compound ID AaLMcVria7w
InChI InChI=1S/C33H27N2O3P/c1-38-33(37)29-22-12-13-23-30(29)34-32(36)28-21-11-14-24-31(28)35-39(25-15-5-2-6-16-25,26-17-7-3-8-18-26)27-19-9-4-10-20-27/h2-24H,1H3,(H,34,36)
InChIKey FMFJGBRDEHLPIU-UHFFFAOYSA-N
Mol Weight 530.6 g/mol
Molecular Formula C33H27N2O3P
Exact Mass 530.17593 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 89yfnOGHN0H
Name Benzoic acid, 2-[[2-[(triphenylphosphoranylidene)amino]benzoyl]amino]-, methyl ester
CAS Registry Number 125701-41-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H27N2O3P
InChI InChI=1S/C33H27N2O3P/c1-38-33(37)29-22-12-13-23-30(29)34-32(36)28-21-11-14-24-31(28)35-39(25-15-5-2-6-16-25,26-17-7-3-8-18-26)27-19-9-4-10-20-27/h2-24H,1H3,(H,34,36)
InChIKey FMFJGBRDEHLPIU-UHFFFAOYSA-N
Molecular Weight 530.564 g/mol
SMILES N(C(c1c(N=P(c2ccccc2)(c2ccccc2)c2ccccc2)cccc1)=O)c1c(C(=O)OC)cccc1
SPLASH splash10-001i-2920000000-cb5ea5841f1b3b4e04b4
Source of Spectrum F-45-4283-36
Synonyms Methyl 2-({2-[(triphenylphosphoranylidene)amino]benzoyl}amino)benzoate N-(2-methoxycarbonylphenyl)-2-(triphenylphosphoranylidene amino)-benzamide P,p,p-triphenyl-2-(2-methoxycarbonylphenyl)aminophenyliminophosphorane
Wiley ID 1403385