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4-[N-(4-Methylbenzoyl)-N-(4-methylphenyl)amino]methyl-3-methyl-1-phenyl-5-[(triphenylphosphoranylidene)amino]-1H-pyrazole

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4-[N-(4-Methylbenzoyl)-N-(4-methylphenyl)amino]methyl-3-methyl-1-phenyl-5-[(triphenylphosphoranylidene)amino]-1H-pyrazole
SpectraBase Compound ID 5OKKjQQ41wh
InChI InChI=1S/C44H39N4OP/c1-33-24-28-36(29-25-33)44(49)47(37-30-26-34(2)27-31-37)32-42-35(3)45-48(38-16-8-4-9-17-38)43(42)46-50(39-18-10-5-11-19-39,40-20-12-6-13-21-40)41-22-14-7-15-23-41/h4-31H,32H2,1-3H3
InChIKey FETSHKJBBJETAN-UHFFFAOYSA-N
Mol Weight 670.8 g/mol
Molecular Formula C44H39N4OP
Exact Mass 670.286149 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lmr6sm8rROF
Name 4-[N-(4-Methylbenzoyl)-N-(4-methylphenyl)amino]methyl-3-methyl-1-phenyl-5-[(triphenylphosphoranylidene)amino]-1H-pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C44H39N4OP
InChI InChI=1S/C44H39N4OP/c1-33-24-28-36(29-25-33)44(49)47(37-30-26-34(2)27-31-37)32-42-35(3)45-48(38-16-8-4-9-17-38)43(42)46-50(39-18-10-5-11-19-39,40-20-12-6-13-21-40)41-22-14-7-15-23-41/h4-31H,32H2,1-3H3
InChIKey FETSHKJBBJETAN-UHFFFAOYSA-N
Molecular Weight 670.797 g/mol
SMILES c1(c(c(C)n[n]1-c1ccccc1)CN(C(c1ccc(cc1)C)=O)c1ccc(cc1)C)N=P(c1ccccc1)(c1ccccc1)c1ccccc1
SPLASH splash10-015a-2900200000-69efe13a700ff4668ff3
Source of Spectrum SO-0-470-7
Synonyms 4-Methyl-N-(4-methylphenyl)-N-({3-methyl-1-phenyl-5-[(triphenylphosphoranylidene)amino]-1H-pyrazol-4-yl}methyl)benzamide
Wiley ID 1541354