| SpectraBase Compound ID | 7fwNumC9eLY |
|---|---|
| InChI | InChI=1S/C12H8N4O2/c17-16(18)10-6-7-11-12(8-10)15(14-13-11)9-4-2-1-3-5-9/h1-8H |
| InChIKey | ABTQEKGTMWYYCB-UHFFFAOYSA-N |
| Mol Weight | 240.22 g/mol |
| Molecular Formula | C12H8N4O2 |
| Exact Mass | 240.064726 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DTM7YbAw8mZ |
|---|---|
| Name | 6-Nitro-1-phenyl-1,2,3-benzotriazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.064725512 u |
| Formula | C12H8N4O2 |
| InChI | InChI=1S/C12H8N4O2/c17-16(18)10-6-7-11-12(8-10)15(14-13-11)9-4-2-1-3-5-9/h1-8H |
| InChIKey | ABTQEKGTMWYYCB-UHFFFAOYSA-N |
| Molecular Weight | 240.222 g/mol |
| SMILES | C1=C(C=CC2=C1N(C1=CC=CC=C1)N=N2)N(=O)=O |