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3-(4-Methoxyphenylamino)-6-methyl-4-triphenylphosphoranylidenamino-5-oxo-4,5-dihydro-1,2,4-triazine
SpectraBase Compound ID A9NcRvlNau5
InChI InChI=1S/C29H26N5O2P/c1-22-28(35)34(29(32-31-22)30-23-18-20-24(36-2)21-19-23)33-37(25-12-6-3-7-13-25,26-14-8-4-9-15-26)27-16-10-5-11-17-27/h3-21H,1-2H3,(H,30,32)
InChIKey MJLQIDXXVPNHLL-UHFFFAOYSA-N
Mol Weight 507.53 g/mol
Molecular Formula C29H26N5O2P
Exact Mass 507.182412 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5qyi8elZVMy
Name 3-(4-Methoxyphenylamino)-6-methyl-4-triphenylphosphoranylidenamino-5-oxo-4,5-dihydro-1,2,4-triazine
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Formula C29H26N5O2P
InChI InChI=1S/C29H26N5O2P/c1-22-28(35)34(29(32-31-22)30-23-18-20-24(36-2)21-19-23)33-37(25-12-6-3-7-13-25,26-14-8-4-9-15-26)27-16-10-5-11-17-27/h3-21H,1-2H3,(H,30,32)
InChIKey MJLQIDXXVPNHLL-UHFFFAOYSA-N
Molecular Weight 507.534 g/mol
SMILES N(C1=NN=C(C(N1N=P(c1ccccc1)(c1ccccc1)c1ccccc1)=O)C)c1ccc(cc1)OC
SPLASH splash10-004i-0980000000-80b67c2c16ddb83a2155
Source of Spectrum SO-0-984-4
Synonyms 3-(4-Methoxyanilino)-6-methyl-4-[(triphenylphosphoranylidene)amino]-1,2,4-triazin-5(4H)-one
Wiley ID 1538321