| SpectraBase Compound ID | AvFsOI02q0j |
|---|---|
| InChI | InChI=1S/C10H11BrO2/c1-8(12)13-7-10-4-2-9(6-11)3-5-10/h2-5H,6-7H2,1H3 |
| InChIKey | XUHQNLBUPMHGQM-UHFFFAOYSA-N |
| Mol Weight | 243.1 g/mol |
| Molecular Formula | C10H11BrO2 |
| Exact Mass | 241.994243 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AF6Ze5cwScz |
|---|---|
| Name | 4-(Bromomethyl)benzyl acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 241.994242592 u |
| Formula | C10H11BrO2 |
| InChI | InChI=1S/C10H11BrO2/c1-8(12)13-7-10-4-2-9(6-11)3-5-10/h2-5H,6-7H2,1H3 |
| InChIKey | XUHQNLBUPMHGQM-UHFFFAOYSA-N |
| Molecular Weight | 243.100 g/mol |
| SMILES | C(=O)(OCC=1C=CC(=CC1)CBr)C |