| SpectraBase Compound ID | 1lg75EOW2y0 |
|---|---|
| InChI | InChI=1S/C16H16ClNO/c1-10-8-11(2)15(12(3)9-10)18-16(19)13-6-4-5-7-14(13)17/h4-9H,1-3H3,(H,18,19) |
| InChIKey | GGUSVCZEIJYNJF-UHFFFAOYSA-N |
| Mol Weight | 273.76 g/mol |
| Molecular Formula | C16H16ClNO |
| Exact Mass | 273.092042 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | HiF9r2Aenp6 |
|---|---|
| Name | 2-Chloro-N-mesitylbenzamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 273.092041838 u |
| Formula | C16H16ClNO |
| InChI | InChI=1S/C16H16ClNO/c1-10-8-11(2)15(12(3)9-10)18-16(19)13-6-4-5-7-14(13)17/h4-9H,1-3H3,(H,18,19) |
| InChIKey | GGUSVCZEIJYNJF-UHFFFAOYSA-N |
| SMILES | C1(Cl)=C(C=CC=C1)C(=O)NC1=C(C=C(C=C1C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.924055 |