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1H-1,2,3-Triazole-4-carboxaldehyde
SpectraBase Compound ID 7gwdEaaOiiV
InChI InChI=1S/C3H3N3O/c7-2-3-1-4-6-5-3/h1-2H,(H,4,5,6)
InChIKey MOLKLIYWXFEEJM-UHFFFAOYSA-N
Mol Weight 97.077 g/mol
Molecular Formula C3H3N3O
Exact Mass 97.027612 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 110aPGryMOI
Name 1H-1,2,3-Triazole-4-carboxaldehyde
CAS Registry Number 16681-68-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C3H3N3O
InChI InChI=1S/C3H3N3O/c7-2-3-1-4-6-5-3/h1-2H,(H,4,5,6)
InChIKey MOLKLIYWXFEEJM-UHFFFAOYSA-N
Molecular Weight 97.077 g/mol
SMILES [nH]1nnc(c1)C=O
SPLASH splash10-0002-9000000000-33f339267786a44e52e1
Source of Spectrum KC-1979-16-1
Synonyms 1H-1,2,3-Triazole-4-carbaldehyde 2H-1,2,3-triazole-4-carbaldehyde 2H-triazole-4-carbaldehyde 2H-triazole-4-carboxaldehyde v-Triazole-4-carboxaldehyde
Wiley ID 1118336