| SpectraBase Compound ID | LTLtP0QXYM4 |
|---|---|
| InChI | InChI=1S/C13H12ClN/c1-9-5-7-10(8-6-9)13-11(14)3-2-4-12(13)15/h2-8H,15H2,1H3 |
| InChIKey | JWGCNOVOQQRDFU-UHFFFAOYSA-N |
| Mol Weight | 217.7 g/mol |
| Molecular Formula | C13H12ClN |
| Exact Mass | 217.065827 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 5kpAzqZVuU1 |
|---|---|
| Name | 6-Chloro-4'-methylbiphenyl-2-amine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 217.065827090 u |
| Formula | C13H12ClN |
| InChI | InChI=1S/C13H12ClN/c1-9-5-7-10(8-6-9)13-11(14)3-2-4-12(13)15/h2-8H,15H2,1H3 |
| InChIKey | JWGCNOVOQQRDFU-UHFFFAOYSA-N |
| Molecular Weight | 217.699 g/mol |
| SMILES | C=1C(=C(C2=CC=C(C=C2)C)C(=CC1)Cl)N |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.923471 |