| SpectraBase Compound ID | 6R5bmY2AX87 |
|---|---|
| InChI | InChI=1S/C11H14ClN5/c1-2-6-17-11(14-15-16-17)13-8-9-4-3-5-10(12)7-9/h3-5,7H,2,6,8H2,1H3,(H,13,14,16) |
| InChIKey | PQWXBEVJLODOAS-UHFFFAOYSA-N |
| Mol Weight | 251.72 g/mol |
| Molecular Formula | C11H14ClN5 |
| Exact Mass | 251.093773 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | DUovbWMEjmO |
|---|---|
| Name | N-(3-Chlorobenzyl)-1-propyl-1H-tetraazol-5-amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 251.093773171 u |
| Formula | C11H14ClN5 |
| InChI | InChI=1S/C11H14ClN5/c1-2-6-17-11(14-15-16-17)13-8-9-4-3-5-10(12)7-9/h3-5,7H,2,6,8H2,1H3,(H,13,14,16) |
| InChIKey | PQWXBEVJLODOAS-UHFFFAOYSA-N |
| SMILES | N(C=1N(N=NN1)CCC)CC=1C=C(Cl)C=CC1 |