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1H-1,2,4-Triazole-3-carboxaldehyde, 5-(4-pyridinyl)-
SpectraBase Compound ID GShMmMoUFRL
InChI InChI=1S/C8H6N4O/c13-5-7-10-8(12-11-7)6-1-3-9-4-2-6/h1-5H,(H,10,11,12)
InChIKey QRXIAHCGICSYLT-UHFFFAOYSA-N
Mol Weight 174.16 g/mol
Molecular Formula C8H6N4O
Exact Mass 174.054161 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DXvj65HnQfZ
Name 1H-1,2,4-Triazole-3-carboxaldehyde, 5-(4-pyridinyl)-
CAS Registry Number 42786-73-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6N4O
InChI InChI=1S/C8H6N4O/c13-5-7-10-8(12-11-7)6-1-3-9-4-2-6/h1-5H,(H,10,11,12)
InChIKey QRXIAHCGICSYLT-UHFFFAOYSA-N
Molecular Weight 174.163 g/mol
SMILES [nH]1nc(nc1C=O)-c1ccncc1
SPLASH splash10-0imi-9300000000-3582c06258d54759e3fb
Source of Spectrum EP-7326-0-0
Synonyms 5-(4-Pyridinyl)-4H-1,2,4-triazole-3-carbaldehyde 3-(4-pyridyl)-1H-1,2,4-triazole-5-carbaldehyde 3-Pyridin-4-yl-1H-1,2,4-triazole-5-carbaldehyde 3-Pyridin-4-yl-1H-1,2,4-triazole-5-carboxaldehyde
Wiley ID 1170182