| SpectraBase Compound ID | 6tejEQwI0MO |
|---|---|
| InChI | InChI=1S/C9H8N4/c1-7-10-12-9(13-11-7)8-5-3-2-4-6-8/h2-6H,1H3 |
| InChIKey | RIEDBFFMXQWXTM-UHFFFAOYSA-N |
| Mol Weight | 172.19 g/mol |
| Molecular Formula | C9H8N4 |
| Exact Mass | 172.074896 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6s81JPTbKDd |
|---|---|
| Name | 3-Phenyl-6-methyl-1,2,4,5-tetrazine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H8N4 |
| InChI | InChI=1S/C9H8N4/c1-7-10-12-9(13-11-7)8-5-3-2-4-6-8/h2-6H,1H3 |
| InChIKey | RIEDBFFMXQWXTM-UHFFFAOYSA-N |
| Molecular Weight | 172.191 g/mol |
| SMILES | c1(nnc(nn1)C)-c1ccccc1 |
| SPLASH | splash10-0udi-1900000000-e48afcc6678397b39a90 |
| Source of Spectrum | Y-45-1748-4a |
| Wiley ID | 1666610 |