| SpectraBase Compound ID | LxR7ifnZdkQ |
|---|---|
| InChI | InChI=1S/C10H11ClN2/c11-8-1-2-10-9(5-8)7(3-4-12)6-13-10/h1-2,5-6,13H,3-4,12H2 |
| InChIKey | FVQKQPVVCKOWLM-UHFFFAOYSA-N |
| Mol Weight | 194.66 g/mol |
| Molecular Formula | C10H11ClN2 |
| Exact Mass | 194.061076 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6D1nhaIoR0U |
|---|---|
| Name | 1H-Indole-3-ethanamine, 5-chloro- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.061076062 u |
| Formula | C10H11ClN2 |
| InChI | InChI=1S/C10H11ClN2/c11-8-1-2-10-9(5-8)7(3-4-12)6-13-10/h1-2,5-6,13H,3-4,12H2 |
| InChIKey | FVQKQPVVCKOWLM-UHFFFAOYSA-N |
| Molecular Weight | 194.665 g/mol |
| SMILES | C12=C(C=CC(=C2)Cl)NC=C1CCN |