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6-TRIPHENYLPHOSPHORANYLIDENEAMINO-5-(3-TRIFLUOROMETHYLPHENYL)-AMIDOPYRIMIDINE-2,4-(1H,3H)-DIONE
SpectraBase Compound ID AOZt7DUHxhv
InChI InChI=1S/C32H26F3N4O3P/c1-38-28(27(30(41)39(2)31(38)42)29(40)36-23-14-12-13-22(21-23)32(33,34)35)37-43(24-15-6-3-7-16-24,25-17-8-4-9-18-25)26-19-10-5-11-20-26/h3-21H,1-2H3,(H,36,40)
InChIKey FICSVMVJOAFMFS-UHFFFAOYSA-N
Mol Weight 602.6 g/mol
Molecular Formula C32H26F3N4O3P
Exact Mass 602.169462 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KoRcIV5sRLW
Name 1,3-Dimethyl-6-triphenylphosphoranylideneamino-5-(3-trifluoromethylphenylamido)uracil
Comments Less than 3 mono-isotopic peaks
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Formula C32H26F3N4O3P
InChI InChI=1S/C32H26F3N4O3P/c1-38-28(27(30(41)39(2)31(38)42)29(40)36-23-14-12-13-22(21-23)32(33,34)35)37-43(24-15-6-3-7-16-24,25-17-8-4-9-18-25)26-19-10-5-11-20-26/h3-21H,1-2H3,(H,36,40)
InChIKey FICSVMVJOAFMFS-UHFFFAOYSA-N
Molecular Weight 602.554 g/mol
SMILES N(C(C1=C(N(C(N(C)C1=O)=O)C)N=P(c1ccccc1)(c1ccccc1)c1ccccc1)=O)c1cc(C(F)(F)F)ccc1
SPLASH splash10-0006-0000900000-ca12fdc848b26e71037b
Source of Spectrum H1-35-1061-7
Synonyms 1,3-dimethyl-2,4-dioxo-N-[3-(trifluoromethyl)phenyl]-6-[(triphenylphosphoranylidene)amino]-1,2,3,4-tetrahydro-5-pyrimidinecarboxamide
Wiley ID 755017