5-Methylbenzotriazole
985
Reference
5-Methylbenzotriazole Structure
Systematic / IUPAC Name: 5-Methyl-1H-benzotriazole
ID: Reference985
Other Names:
Tolutriazole;
1H-Benzotriazole, 5-methyl-;
5-Tolyltriazole;
6-Methylbenzotriazole;
1H-Benzotriazole, 6-methyl-
; more
Formula: C7H7N3
Spectral Data
5-Methylbenzotriazole mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | LTQ Orbitrap XL |
| No. of Spectral Trees | 1 |
| No. of Spectra | 68 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | ESI |
| Analyzers | FT |
| Last Modification | 8/1/2014 11:00:29 AM |
Identificators
| InChI | InChI=1S/C7H7N3/c1-5-2-3-6-7(4-5)9-10-8-6/h2-4H,1H3,(H,8,9,10) |
| InChI Key | LRUDIIUSNGCQKF-UHFFFAOYSA-N |
| Canonical SMILES | CC1=CC2=C(C=C1)NN=N2 |
| CAS | 136856 |
| Splash | |
| Other Names |
Tolutriazole; 1H-Benzotriazole, 5-methyl-; 5-Tolyltriazole; 6-Methylbenzotriazole; 1H-Benzotriazole, 6-methyl-; 5-Methyl-1,2,3-benzotriazole; 6-Methyl-1,2,3-benzotriazole; 5-Methyl-1H-benzo[d][1,2,3]triazole; 6-Methyl-1H-benzotriazole |