| SpectraBase Compound ID | 4qJH7hQHYUA |
|---|---|
| InChI | InChI=1S/C10H11BrO2/c1-3-9(12)7-4-6(2)10(13)8(11)5-7/h4-5,13H,3H2,1-2H3 |
| InChIKey | LHPTVACGFRKWHR-UHFFFAOYSA-N |
| Mol Weight | 243.1 g/mol |
| Molecular Formula | C10H11BrO2 |
| Exact Mass | 241.994243 g/mol |
Raman Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | DPdMKhYRdV7 |
|---|---|
| Name | 3'-Bromo-4'-hydroxy-5'-methylpropiophenone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 241.994242592 u |
| Formula | C10H11BrO2 |
| InChI | InChI=1S/C10H11BrO2/c1-3-9(12)7-4-6(2)10(13)8(11)5-7/h4-5,13H,3H2,1-2H3 |
| InChIKey | LHPTVACGFRKWHR-UHFFFAOYSA-N |
| Molecular Weight | 243.100 g/mol |
| SMILES | OC=1C(=CC(=CC1C)C(CC)=O)Br |
| Spectrum/Structure Validation Score (Raman) | 0.960832 |