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1H-1,2,3-triazole-4-carboxylic acid, 5-chloro-, methyl ester
SpectraBase Compound ID 7tsthGZbSJ4
InChI InChI=1S/C4H4ClN3O2/c1-10-4(9)2-3(5)7-8-6-2/h1H3,(H,6,7,8)
InChIKey FTUOGIDBNRPVFI-UHFFFAOYSA-N
Mol Weight 161.55 g/mol
Molecular Formula C4H4ClN3O2
Exact Mass 160.999204 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DImPBXxtVue
Name 1H-1,2,3-Triazole-4-carboxylic acid, 5-chloro-, methyl ester
CAS Registry Number 88474-33-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H4ClN3O2
InChI InChI=1S/C4H4ClN3O2/c1-10-4(9)2-3(5)7-8-6-2/h1H3,(H,6,7,8)
InChIKey FTUOGIDBNRPVFI-UHFFFAOYSA-N
Molecular Weight 161.548 g/mol
SMILES [nH]1nnc(c1Cl)C(=O)OC
SPLASH splash10-001i-7900000000-31981b352c0d78c3fa49
Synonyms 5-Chloro-1H-1,2,3-triazole-4-carboxylic acid methyl ester 5-Chloro-2H-triazole-4-carboxylic acid methyl ester Methyl 5-chloranyl-2H-1,2,3-triazole-4-carboxylate Methyl 5-chloro-1H-1,2,3-triazole-4-carboxylate Methyl 5-chloro-2H-triazole-4-carboxylate
Wiley ID 1437551