| SpectraBase Compound ID | IN0ys35AeGr |
|---|---|
| InChI | InChI=1S/C13H10ClN/c14-12-7-4-8-13(9-12)15-10-11-5-2-1-3-6-11/h1-10H/b15-10+ |
| InChIKey | ZEXWWDRAHMCQOE-XNTDXEJSSA-N |
| Mol Weight | 215.68 g/mol |
| Molecular Formula | C13H10ClN |
| Exact Mass | 215.050177 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | K4fkMWnUg2s |
|---|---|
| Name | (E)-N-Benzylidene-3-chloroaniline |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 215.050177026 u |
| Formula | C13H10ClN |
| InChI | InChI=1S/C13H10ClN/c14-12-7-4-8-13(9-12)15-10-11-5-2-1-3-6-11/h1-10H/b15-10+ |
| InChIKey | ZEXWWDRAHMCQOE-XNTDXEJSSA-N |
| Molecular Weight | 215.683 g/mol |
| SMILES | C=1(\N=C\C=2C=CC=CC2)C=C(C=CC1)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.857529 |