| SpectraBase Compound ID | 1jOBGsYt4oK |
|---|---|
| InChI | InChI=1S/C16H24ClNO/c1-3-5-6-7-8-13-18(4-2)16(19)14-9-11-15(17)12-10-14/h9-12H,3-8,13H2,1-2H3 |
| InChIKey | IDBIVXQHJAEJKP-UHFFFAOYSA-N |
| Mol Weight | 281.83 g/mol |
| Molecular Formula | C16H24ClNO |
| Exact Mass | 281.154642 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7wwfqI2SZoi |
|---|---|
| Name | Benzamide, 4-chloro-N-ethyl-N-heptyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 281.154642096 u |
| Formula | C16H24ClNO |
| InChI | InChI=1S/C16H24ClNO/c1-3-5-6-7-8-13-18(4-2)16(19)14-9-11-15(17)12-10-14/h9-12H,3-8,13H2,1-2H3 |
| InChIKey | IDBIVXQHJAEJKP-UHFFFAOYSA-N |
| SMILES | C1=CC(=CC=C1C(N(CC)CCCCCCC)=O)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.879283 |