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1-(Methylthio)-7-methyl-3,4-diphenylpyrazolo[1,2-a]-(1,2,4)-triazin-6-one
SpectraBase Compound ID LtKNYXVpIZ
InChI InChI=1S/C20H17N3OS/c1-14-13-22-20(25-2)21-17(15-9-5-3-6-10-15)18(23(22)19(14)24)16-11-7-4-8-12-16/h3-13H,1-2H3
InChIKey LJJRYUZDXMJVTL-UHFFFAOYSA-N
Mol Weight 347.44 g/mol
Molecular Formula C20H17N3OS
Exact Mass 347.109233 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kmnf4cMnJSD
Name 1-(Methylthio)-7-methyl-3,4-diphenylpyrazolo[1,2-a]-(1,2,4)-triazin-6-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H17N3OS
InChI InChI=1S/C20H17N3OS/c1-14-13-22-20(25-2)21-17(15-9-5-3-6-10-15)18(23(22)19(14)24)16-11-7-4-8-12-16/h3-13H,1-2H3
InChIKey LJJRYUZDXMJVTL-UHFFFAOYSA-N
Molecular Weight 347.436 g/mol
SMILES C=1(N2N(C(=C(N1)c1ccccc1)c1ccccc1)C(C(=C2)C)=O)SC
SPLASH splash10-0f6t-0009000000-50104cb1eabaefc735d0
Source of Spectrum D8-327-480-22
Synonyms 7-methyl-1-(methylsulfanyl)-3,4-diphenyl-6H-pyrazolo[1,2-a][1,2,4]triazin-6-one
Wiley ID 1515388