| SpectraBase Spectrum ID |
9m3u0iPfaHD |
| Name |
6-Trifluoromethyl-1,2,3-benzotriazin-4(3H)-one N2-oxide |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C8H4F3N3O2 |
| InChI |
InChI=1S/C8H4F3N3O2/c9-8(10,11)4-1-2-6-5(3-4)7(15)13-14(16)12-6/h1-3H,(H,12,13,15) |
| InChIKey |
AERWWNCQEVQVHI-UHFFFAOYSA-N |
| Molecular Weight |
231.134 g/mol |
| SMILES |
N1C(c2c(N=[N+]1[O-])ccc(c2)C(F)(F)F)=O |
| SPLASH |
splash10-001i-0490000000-854731d0005f31d6d533 |
| Source of Spectrum |
SO-0-518-5 |
| Synonyms |
6-(trifluoromethyl)-1,2,3-benzotriazin-4(3H)-one 2-oxide
2-oxidanidyl-6-(trifluoromethyl)-1H-1,2,3-benzotriazin-2-ium-4-one |
| Wiley ID |
1540122 |
