| SpectraBase Compound ID | JdAaELfun0k |
|---|---|
| InChI | InChI=1S/C8H10ClN/c9-8(6-10)7-4-2-1-3-5-7/h1-5,8H,6,10H2 |
| InChIKey | IUAYUYABWKLCER-UHFFFAOYSA-N |
| Mol Weight | 155.63 g/mol |
| Molecular Formula | C8H10ClN |
| Exact Mass | 155.050177 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 9kwTuMnPtzP |
|---|---|
| Name | 2-Chloro-2-phenylethylamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 155.050177026 u |
| Formula | C8H10ClN |
| InChI | InChI=1S/C8H10ClN/c9-8(6-10)7-4-2-1-3-5-7/h1-5,8H,6,10H2 |
| InChIKey | IUAYUYABWKLCER-UHFFFAOYSA-N |
| SMILES | C(N)C(Cl)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.986442 |