| SpectraBase Compound ID | 2Lz2iJMPLq7 |
|---|---|
| InChI | InChI=1S/C10H10BrClO/c1-7(13)9(11)10(12)8-5-3-2-4-6-8/h2-6,9-10H,1H3 |
| InChIKey | WTAOQDJTRNOOER-UHFFFAOYSA-N |
| Mol Weight | 261.55 g/mol |
| Molecular Formula | C10H10BrClO |
| Exact Mass | 259.960356 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 1djBmCJpip8 |
|---|---|
| Name | 3-Bromo-4-chloro-4-phenylbutan-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 259.960355641 u |
| Formula | C10H10BrClO |
| InChI | InChI=1S/C10H10BrClO/c1-7(13)9(11)10(12)8-5-3-2-4-6-8/h2-6,9-10H,1H3 |
| InChIKey | WTAOQDJTRNOOER-UHFFFAOYSA-N |
| SMILES | CC(C(C(C=1C=CC=CC1)Cl)Br)=O |