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1-Phenyl-4,5-dihydro-1H-1,2,3-triazole-4-carboxylic acid
SpectraBase Compound ID G9te9wyyZGJ
InChI InChI=1S/C9H9N3O2/c13-9(14)8-6-12(11-10-8)7-4-2-1-3-5-7/h1-5,8H,6H2,(H,13,14)
InChIKey VUTHXGJTAXFUQQ-UHFFFAOYSA-N
Mol Weight 191.19 g/mol
Molecular Formula C9H9N3O2
Exact Mass 191.069477 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H9Ntt53Im05
Name 1-Phenyl-4,5-dihydro-1H-1,2,3-triazole-4-carboxylic acid
CAS Registry Number 54798-96-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9N3O2
InChI InChI=1S/C9H9N3O2/c13-9(14)8-6-12(11-10-8)7-4-2-1-3-5-7/h1-5,8H,6H2,(H,13,14)
InChIKey VUTHXGJTAXFUQQ-UHFFFAOYSA-N
Molecular Weight 191.190 g/mol
SMILES OC(C1CN(c2ccccc2)N=N1)=O
SPLASH splash10-0j4l-9100000000-e2e80fb49b487230cf3b
Source of Spectrum TA-0-1237-0
Synonyms 1-Phenyl-4,5-dihydro-1,2,3-triazole-4-carboxylic acid 1-Phenyl-4,5-dihydrotriazole-4-carboxylic acid
Wiley ID 20892