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s-Triazole-3-carboxaldehyde, 5-phenyl-

View entire compound with spectra: 2 MS (GC)

s-Triazole-3-carboxaldehyde, 5-phenyl-
SpectraBase Compound ID 8cX9XHLiUOi
InChI InChI=1S/C9H7N3O/c13-6-8-10-9(12-11-8)7-4-2-1-3-5-7/h1-6H,(H,10,11,12)
InChIKey KGONHESTSCTJLO-UHFFFAOYSA-N
Mol Weight 173.17 g/mol
Molecular Formula C9H7N3O
Exact Mass 173.058912 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1SsZIpC92G
Name s-Triazole-3-carboxaldehyde, 5-phenyl-
CAS Registry Number 26899-64-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7N3O
InChI InChI=1S/C9H7N3O/c13-6-8-10-9(12-11-8)7-4-2-1-3-5-7/h1-6H,(H,10,11,12)
InChIKey KGONHESTSCTJLO-UHFFFAOYSA-N
Molecular Weight 173.175 g/mol
SMILES [nH]1nc(nc1C=O)-c1ccccc1
SPLASH splash10-00dl-7900000000-f7e071a5dbfdf2d2009a
Source of Spectrum B-26-1814-99
Synonyms 5-Phenyl-4H-1,2,4-triazole-3-carbaldehyde 3-Phenyl-1H-1,2,4-triazole-5-carbaldehyde 3-Phenyl-1H-1,2,4-triazole-5-carboxaldehyde
Wiley ID 1169731