| SpectraBase Compound ID | F3Va8Y7RRXP |
|---|---|
| InChI | InChI=1S/C11H13ClO2/c1-9(13)14-8-7-11(12)10-5-3-2-4-6-10/h2-6,11H,7-8H2,1H3 |
| InChIKey | ZAFOXHDBUKFFLP-UHFFFAOYSA-N |
| Mol Weight | 212.68 g/mol |
| Molecular Formula | C11H13ClO2 |
| Exact Mass | 212.060407 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9z02gYDCU29 |
|---|---|
| Name | (-)-3-chloro-3-phenylpropyl acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.060407357 u |
| Formula | C11H13ClO2 |
| InChI | InChI=1S/C11H13ClO2/c1-9(13)14-8-7-11(12)10-5-3-2-4-6-10/h2-6,11H,7-8H2,1H3 |
| InChIKey | ZAFOXHDBUKFFLP-UHFFFAOYSA-N |
| Molecular Weight | 212.676 g/mol |
| SMILES | C(C)(=O)OCCC(C=1C=CC=CC1)Cl |