| SpectraBase Compound ID | 9ZMmM07Wj2d |
|---|---|
| InChI | InChI=1S/C11H12ClN/c12-9-5-1-2-6-10-7-3-4-8-11(10)13/h3-4,7-8H,1,5,9,13H2 |
| InChIKey | ZAHRBMHRJSGZSC-UHFFFAOYSA-N |
| Mol Weight | 193.68 g/mol |
| Molecular Formula | C11H12ClN |
| Exact Mass | 193.065827 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 7cwge0YO1zN |
|---|---|
| Name | 2-(5-Chloro-1-pentynyl)aniline |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 193.065827090 u |
| Formula | C11H12ClN |
| InChI | InChI=1S/C11H12ClN/c12-9-5-1-2-6-10-7-3-4-8-11(10)13/h3-4,7-8H,1,5,9,13H2 |
| InChIKey | ZAHRBMHRJSGZSC-UHFFFAOYSA-N |
| Molecular Weight | 193.677 g/mol |
| SMILES | C(#CCCCCl)C=1C(N)=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.91545 |