| SpectraBase Compound ID | C1tIUokQP9f |
|---|---|
| InChI | InChI=1S/C12H16N8/c1-7-5-9(3)19(17-7)11-13-15-12(16-14-11)20-10(4)6-8(2)18-20/h5-6H,1-4H3,(H,13,14)(H,15,16) |
| InChIKey | INBAVOCGMVJPTG-UHFFFAOYSA-N |
| Mol Weight | 272.32 g/mol |
| Molecular Formula | C12H16N8 |
| Exact Mass | 272.149793 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 7R5FFH0nhyY |
|---|---|
| Name | 1,2,4,5-Tetrazine, 3,6-bis(3,5-dimethyl-1H-pyrazol-1-yl)-1,4-dihydro- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 272.149792547 u |
| Formula | C12H16N8 |
| InChI | InChI=1S/C12H16N8/c1-7-5-9(3)19(17-7)11-13-15-12(16-14-11)20-10(4)6-8(2)18-20/h5-6H,1-4H3,(H,13,14)(H,15,16) |
| InChIKey | INBAVOCGMVJPTG-UHFFFAOYSA-N |
| SMILES | N1N=C(NN=C1N1C(=CC(=N1)C)C)N1N=C(C=C1C)C |