| SpectraBase Compound ID | JzmEBR44jg2 |
|---|---|
| InChI | InChI=1S/C11H12ClNO/c1-13(2)8-7-11(14)9-3-5-10(12)6-4-9/h3-8H,1-2H3 |
| InChIKey | TWBABRJLWCBTBS-UHFFFAOYSA-N |
| Mol Weight | 209.68 g/mol |
| Molecular Formula | C11H12ClNO |
| Exact Mass | 209.060742 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 937bfFI1R0N |
|---|---|
| Name | 4'-Chloro-3-(dimethylamino)acrylophenone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 209.060741709 u |
| Formula | C11H12ClNO |
| InChI | InChI=1S/C11H12ClNO/c1-13(2)8-7-11(14)9-3-5-10(12)6-4-9/h3-8H,1-2H3 |
| InChIKey | TWBABRJLWCBTBS-UHFFFAOYSA-N |
| Molecular Weight | 209.676 g/mol |
| SMILES | C=1C=C(C=CC1Cl)C(C=CN(C)C)=O |
| Spectrum/Structure Validation Score (Raman) | 0.775102 |