| SpectraBase Compound ID | Ka82gmlGjMw |
|---|---|
| InChI | InChI=1S/C13H17Cl2NO2/c1-2-3-9-13(14,15)12(18)16-11(17)10-7-5-4-6-8-10/h4-8,12,18H,2-3,9H2,1H3,(H,16,17) |
| InChIKey | RIXBSURABSDVLJ-UHFFFAOYSA-N |
| Mol Weight | 290.19 g/mol |
| Molecular Formula | C13H17Cl2NO2 |
| Exact Mass | 289.063634 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | FTb0VkESaTA |
|---|---|
| Name | N-(2,2-Dichloro-1-hydroxyhexyl)benzamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 289.063634189 u |
| Formula | C13H17Cl2NO2 |
| InChI | InChI=1S/C13H17Cl2NO2/c1-2-3-9-13(14,15)12(18)16-11(17)10-7-5-4-6-8-10/h4-8,12,18H,2-3,9H2,1H3,(H,16,17) |
| InChIKey | RIXBSURABSDVLJ-UHFFFAOYSA-N |
| SMILES | N(C(C1=CC=CC=C1)=O)C(C(CCCC)(Cl)Cl)O |
| Spectrum/Structure Validation Score (Raman) | 0.878715 |