| SpectraBase Compound ID | 3668H8PMggf |
|---|---|
| InChI | InChI=1S/C10H9ClN2/c11-7-3-4-9-8(6-7)12-10-2-1-5-13(9)10/h3-4,6H,1-2,5H2 |
| InChIKey | MASPHHVIOIFIJH-UHFFFAOYSA-N |
| Mol Weight | 192.65 g/mol |
| Molecular Formula | C10H9ClN2 |
| Exact Mass | 192.045426 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JYivR86IiXx |
|---|---|
| Name | 5-Chloro-1,2-trimethylene benzimidazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 192.045425998 u |
| Formula | C10H9ClN2 |
| InChI | InChI=1S/C10H9ClN2/c11-7-3-4-9-8(6-7)12-10-2-1-5-13(9)10/h3-4,6H,1-2,5H2 |
| InChIKey | MASPHHVIOIFIJH-UHFFFAOYSA-N |
| Molecular Weight | 192.649 g/mol |
| SMILES | C1(Cl)=CC=C2C(=C1)N=C1N2CCC1 |