| SpectraBase Compound ID | EGRqWKPGawc |
|---|---|
| InChI | InChI=1S/C10H14ClN/c1-12(9-5-8-11)10-6-3-2-4-7-10/h2-4,6-7H,5,8-9H2,1H3 |
| InChIKey | GRIGFDIUVHVQCZ-UHFFFAOYSA-N |
| Mol Weight | 183.68 g/mol |
| Molecular Formula | C10H14ClN |
| Exact Mass | 183.081477 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | G7g6AOLnZ7w |
|---|---|
| Name | Aniline, N-(3-chloropropyl)-N-methyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 183.081477155 u |
| Formula | C10H14ClN |
| InChI | InChI=1S/C10H14ClN/c1-12(9-5-8-11)10-6-3-2-4-7-10/h2-4,6-7H,5,8-9H2,1H3 |
| InChIKey | GRIGFDIUVHVQCZ-UHFFFAOYSA-N |
| Molecular Weight | 183.682 g/mol |
| SMILES | C1=CC=CC(=C1)N(C)CCCCl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.974516 |