| SpectraBase Compound ID | 5v64YzUYNy2 |
|---|---|
| InChI | InChI=1S/C8H7BrN6/c9-7-3-1-2-6(4-7)5-11-15-8(10)12-13-14-15/h1-5H,(H2,10,12,14)/b11-5+ |
| InChIKey | AKMLHZKTBPBWAT-VZUCSPMQSA-N |
| Mol Weight | 267.09 g/mol |
| Molecular Formula | C8H7BrN6 |
| Exact Mass | 265.991557 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2nSMDP7WCok |
|---|---|
| Name | N'-(3-Bromobenzyliden)-tetrazole-1,5-diamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 265.991557249 u |
| Formula | C8H7BrN6 |
| InChI | InChI=1S/C8H7BrN6/c9-7-3-1-2-6(4-7)5-11-15-8(10)12-13-14-15/h1-5H,(H2,10,12,14)/b11-5+ |
| InChIKey | AKMLHZKTBPBWAT-VZUCSPMQSA-N |
| SMILES | C1(=NN=NN1\N=C\C=1C=C(C=CC1)Br)N |