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1H-benzotriazole

View entire compound with spectra: 28 NMR, 11 FTIR, 3 Raman, 1 UV-Vis, and 12 MS (GC)

1H-benzotriazole
SpectraBase Compound ID IaJUkL49d5A
InChI InChI=1S/C6H5N3/c1-2-4-6-5(3-1)7-9-8-6/h1-4H,(H,7,8,9)
InChIKey QRUDEWIWKLJBPS-UHFFFAOYSA-N
Mol Weight 119.13 g/mol
Molecular Formula C6H5N3
Exact Mass 119.048347 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ECG3MqkGta2
Name Benzotriazole
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number B11400
CAS Registry Number 95-14-7
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H5N3
InChI InChI=1S/C6H5N3/c1-2-4-6-5(3-1)7-9-8-6/h1-4H,(H,7,8,9)
InChIKey QRUDEWIWKLJBPS-UHFFFAOYSA-N
Observed nucleus 13C
Purity 99%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 1,2,3-Benzotriazole 1H-Benzotriazole
Wiley ID SIAL_13CNMR_010809