| SpectraBase Compound ID | 58fLhPGz2pl |
|---|---|
| InChI | InChI=1S/C9H12ClN/c1-11(8-7-10)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3 |
| InChIKey | KYTLVUBCXILIQO-UHFFFAOYSA-N |
| Mol Weight | 169.65 g/mol |
| Molecular Formula | C9H12ClN |
| Exact Mass | 169.065827 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4XnSeHFGY5Q |
|---|---|
| Name | Aniline, N-(2-chloroethyl)-N-methyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 169.065827090 u |
| Formula | C9H12ClN |
| InChI | InChI=1S/C9H12ClN/c1-11(8-7-10)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3 |
| InChIKey | KYTLVUBCXILIQO-UHFFFAOYSA-N |
| Molecular Weight | 169.655 g/mol |
| SMILES | C1=CC=CC=C1N(C)CCCl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.974542 |