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1,2,4-Triazolo[4,3-a]pyrimidin-3(2H)-one, 5,7-dimethyl-
SpectraBase Compound ID 8tfKsbo3PlE
InChI InChI=1S/C7H8N4O/c1-4-3-5(2)11-6(8-4)9-10-7(11)12/h3H,1-2H3,(H,10,12)
InChIKey KJSPUHDSNMIONN-UHFFFAOYSA-N
Mol Weight 164.17 g/mol
Molecular Formula C7H8N4O
Exact Mass 164.069811 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IdAfb8o2Kn2
Name 1,2,4-Triazolo[4,3-a]pyrimidin-3(2H)-one, 5,7-dimethyl-
CAS Registry Number 41266-64-2
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H8N4O
InChI InChI=1S/C7H8N4O/c1-4-3-5(2)11-6(8-4)9-10-7(11)12/h3H,1-2H3,(H,10,12)
InChIKey KJSPUHDSNMIONN-UHFFFAOYSA-N
Molecular Weight 164.168 g/mol
SMILES N1C(N2C(=N1)N=C(C=C2C)C)=O
SPLASH splash10-0bt9-0900000000-42d3fcbcf8344275ba82
Source of Spectrum KC-1988-356-4
Synonyms 5,7-dimethyl-2H-[1,2,4]triazolo[4,3-a]pyrimidin-3-one 5,7-dimethyl[1,2,4]triazolo[4,3-a]pyrimidin-3(2H)-one
Wiley ID 1159885