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2-(4-Chloroanilino)-3-(triphenylphosphoranylideneamino)-4-quinazolinone
SpectraBase Compound ID 60Rrnmk6MuF
InChI InChI=1S/C32H24ClN4OP/c33-24-20-22-25(23-21-24)34-32-35-30-19-11-10-18-29(30)31(38)37(32)36-39(26-12-4-1-5-13-26,27-14-6-2-7-15-27)28-16-8-3-9-17-28/h1-23H,(H,34,35)
InChIKey XOUSMBZBACCIGU-UHFFFAOYSA-N
Mol Weight 547.0 g/mol
Molecular Formula C32H24ClN4OP
Exact Mass 546.137626 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6XW8NxG0Uwc
Name 2-(4-Chloroanilino)-3-(triphenylphosphoranylideneamino)-4-quinazolinone
Alternate Name(s) 2-(4-Chloroanilino)-3-(triphenylphosphoranylideneamino)quinazolin-4-one 2-(4-Chloroanilino)-3-[(triphenyl-$l^{5}-phosphanylidene)amino]quinazolin-4-one
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Formula C32H24ClN4OP
InChI InChI=1S/C32H24ClN4OP/c33-24-20-22-25(23-21-24)34-32-35-30-19-11-10-18-29(30)31(38)37(32)36-39(26-12-4-1-5-13-26,27-14-6-2-7-15-27)28-16-8-3-9-17-28/h1-23H,(H,34,35)
InChIKey XOUSMBZBACCIGU-UHFFFAOYSA-N
Molecular Weight 546.998 g/mol
SMILES N(C1=Nc2c(C(N1N=P(c1ccccc1)(c1ccccc1)c1ccccc1)=O)cccc2)c1ccc(cc1)Cl
SPLASH splash10-0032-0590080000-c9bf35ddbd711c414bfa
Source of Spectrum K1-2004-3875-5
Wiley ID 1561475