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3-(Benzylamino)-7-methyl-1-phenyl[1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one
SpectraBase Compound ID 9IqGwJMkpSC
InChI InChI=1S/C19H17N5O/c1-14-12-17(25)23-18(20-13-15-8-4-2-5-9-15)22-24(19(23)21-14)16-10-6-3-7-11-16/h2-12H,13H2,1H3,(H,20,22)
InChIKey AUQIDOWVUWZFDG-UHFFFAOYSA-N
Mol Weight 331.38 g/mol
Molecular Formula C19H17N5O
Exact Mass 331.14331 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8kRNNR0qWRY
Name 3-(Benzylamino)-7-methyl-1-phenyl[1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one
Alternate Name(s) 3-(benzylamino)-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 C19H17N5O
InChI InChI=1S/C19H17N5O/c1-14-12-17(25)23-18(20-13-15-8-4-2-5-9-15)22-24(19(23)21-14)16-10-6-3-7-11-16/h2-12H,13H2,1H3,(H,20,22)
InChIKey AUQIDOWVUWZFDG-UHFFFAOYSA-N
Molecular Weight 331.379 g/mol
SMILES N(C=1N2C(N(c3ccccc3)N1)=NC(=CC2=O)C)Cc1ccccc1
SPLASH splash10-000x-9314000000-e2f242b5926165778c42
Source of Spectrum HC-49-1505-8a
Wiley ID 1739308