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6-Methyl-3-(methylthio)-4-(triphenylphosphoranylideneamino)-1,2,4-triazin-5-one
SpectraBase Compound ID 3dWGBwYlcvp
InChI InChI=1S/C23H21N4OPS/c1-18-22(28)27(23(30-2)25-24-18)26-29(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21/h3-17H,1-2H3
InChIKey WVFSMZAABLKASU-UHFFFAOYSA-N
Mol Weight 432.48 g/mol
Molecular Formula C23H21N4OPS
Exact Mass 432.117369 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6LyXl1d6Al4
Name 6-Methyl-3-(methylthio)-4-(triphenylphosphoranylideneamino)-1,2,4-triazin-5-one
CAS Registry Number 109107-00-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H21N4OPS
InChI InChI=1S/C23H21N4OPS/c1-18-22(28)27(23(30-2)25-24-18)26-29(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21/h3-17H,1-2H3
InChIKey WVFSMZAABLKASU-UHFFFAOYSA-N
Molecular Weight 432.482 g/mol
SMILES c1(P(=NN2C(C(C)=NN=C2SC)=O)(c2ccccc2)c2ccccc2)ccccc1
SPLASH splash10-0bt9-2950000000-e549ca0fb960ab766910
Source of Spectrum KC-1986-2044-19
Wiley ID 1382218