| SpectraBase Compound ID | 37GBarzMf1e |
|---|---|
| InChI | InChI=1S/C15H13BrO2/c16-10-12-6-8-14(9-7-12)15(17)18-11-13-4-2-1-3-5-13/h1-9H,10-11H2 |
| InChIKey | NNYOSNCCRWSYQF-UHFFFAOYSA-N |
| Mol Weight | 305.17 g/mol |
| Molecular Formula | C15H13BrO2 |
| Exact Mass | 304.009893 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 | JYs1cAAxOWU |
|---|---|
| Name | (Phenylmethyl) 4-(bromomethyl)benzoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 304.009892657 u |
| Formula | C15H13BrO2 |
| InChI | InChI=1S/C15H13BrO2/c16-10-12-6-8-14(9-7-12)15(17)18-11-13-4-2-1-3-5-13/h1-9H,10-11H2 |
| InChIKey | NNYOSNCCRWSYQF-UHFFFAOYSA-N |
| Molecular Weight | 305.171 g/mol |
| SMILES | C(C=1C=CC(=CC1)CBr)(=O)OCC=1C=CC=CC1 |