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7-Oxo-N-(5-chloro-2-methoxyphenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrimidine-5-carboxamide
SpectraBase Compound ID AAgM8fTe11R
InChI InChI=1S/C13H12ClN5O3/c1-22-10-3-2-7(14)4-8(10)16-12(21)9-5-11(20)17-13-18-15-6-19(9)13/h2-4,6,9H,5H2,1H3,(H,16,21)(H,17,18,20)
InChIKey AXBBYFIXBNJVCY-UHFFFAOYSA-N
Mol Weight 321.72 g/mol
Molecular Formula C13H12ClN5O3
Exact Mass 321.062867 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 11iDpV4Qqc0
Name 7-Oxo-N-(5-chloro-2-methoxyphenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrimidine-5-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12ClN5O3
InChI InChI=1S/C13H12ClN5O3/c1-22-10-3-2-7(14)4-8(10)16-12(21)9-5-11(20)17-13-18-15-6-19(9)13/h2-4,6,9H,5H2,1H3,(H,16,21)(H,17,18,20)
InChIKey AXBBYFIXBNJVCY-UHFFFAOYSA-N
Molecular Weight 321.724 g/mol
SMILES N1C(CC(C(Nc2cc(Cl)ccc2OC)=O)[n]2c1nnc2)=O
SPLASH splash10-001r-6900000000-37e1bb529e78498df858
Source of Spectrum Y-48-893-4e
Synonyms N-(5-chloro-2-methoxyphenyl)-7-oxo-5,6-dihydro-1H-[1,2,4]triazolo[4,3-a]pyrimidine-5-carboxamide N-(5-chloro-2-methoxy-phenyl)-7-oxo-5,6-dihydro-1H-[1,2,4]triazolo[4,3-a]pyrimidine-5-carboxamide N-(5-chloranyl-2-methoxy-phenyl)-7-oxidanylidene-5,6-dihydro-1H-[1,2,4]triazolo[4,3-a]pyrimidine-5-carboxamide
Wiley ID 1667970