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3-Amino-6-(4-methylbenzyl)-7-methyl-1-phenyl-[1,2,4]triazolo[4,3-a]-pyrimidin-5(1H)-one
SpectraBase Compound ID KxjZNPpV7Ft
InChI InChI=1S/C20H19N5O/c1-13-8-10-15(11-9-13)12-17-14(2)22-20-24(18(17)26)19(21)23-25(20)16-6-4-3-5-7-16/h3-11H,12H2,1-2H3,(H2,21,23)
InChIKey RUVBWLBWMHGQOM-UHFFFAOYSA-N
Mol Weight 345.41 g/mol
Molecular Formula C20H19N5O
Exact Mass 345.15896 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2CkxDD6FQh4
Name 3-Amino-6-(4-methylbenzyl)-7-methyl-1-phenyl-[1,2,4]triazolo[4,3-a]-pyrimidin-5(1H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19N5O
InChI InChI=1S/C20H19N5O/c1-13-8-10-15(11-9-13)12-17-14(2)22-20-24(18(17)26)19(21)23-25(20)16-6-4-3-5-7-16/h3-11H,12H2,1-2H3,(H2,21,23)
InChIKey RUVBWLBWMHGQOM-UHFFFAOYSA-N
Molecular Weight 345.406 g/mol
SMILES NC=1N2C(N(c3ccccc3)N1)=NC(=C(C2=O)Cc1ccc(cc1)C)C
SPLASH splash10-0fb9-9433000000-40a6457279f510216280
Source of Spectrum F-66-3310-11d
Wiley ID 1683779