| SpectraBase Compound ID | KOsaGU2HtWP |
|---|---|
| InChI | InChI=1S/C9H12ClN/c1-7(11)5-8-3-2-4-9(10)6-8/h2-4,6-7H,5,11H2,1H3 |
| InChIKey | ORWQJKNRYUIFJU-UHFFFAOYSA-N |
| Mol Weight | 169.66 g/mol |
| Molecular Formula | C9H12ClN |
| Exact Mass | 169.065827 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 | C8yCUjvZ8ZI |
|---|---|
| Name | 3-Chloroamphetamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 169.065827090 u |
| Formula | C9H12ClN |
| InChI | InChI=1S/C9H12ClN/c1-7(11)5-8-3-2-4-9(10)6-8/h2-4,6-7H,5,11H2,1H3 |
| InChIKey | ORWQJKNRYUIFJU-UHFFFAOYSA-N |
| Molecular Weight | 169.655 g/mol |
| SMILES | C(C(C)N)C1=CC(Cl)=CC=C1 |