| SpectraBase Compound ID | 4P0peA9X1AI |
|---|---|
| InChI | InChI=1S/C17H15ClO2/c1-2-12-17(16(19)20,13-6-4-3-5-7-13)14-8-10-15(18)11-9-14/h2-11H,1,12H2,(H,19,20) |
| InChIKey | RXOIGMQVSVNBGB-UHFFFAOYSA-N |
| Mol Weight | 286.76 g/mol |
| Molecular Formula | C17H15ClO2 |
| Exact Mass | 286.076057 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2hKbyyy4ka7 |
|---|---|
| Name | Benzeneacetic acid, 4-chloro-.alpha.-phenyl-.alpha.-2-propenyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 286.076057421 u |
| Formula | C17H15ClO2 |
| InChI | InChI=1S/C17H15ClO2/c1-2-12-17(16(19)20,13-6-4-3-5-7-13)14-8-10-15(18)11-9-14/h2-11H,1,12H2,(H,19,20) |
| InChIKey | RXOIGMQVSVNBGB-UHFFFAOYSA-N |
| SMILES | C(C(=O)O)(C=1C=CC(=CC1)Cl)(C1=CC=CC=C1)CC=C |