| SpectraBase Compound ID | FJ9H9E4SkBD |
|---|---|
| InChI | InChI=1S/C9H7ClO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-6H,(H,11,12)/b8-6- |
| InChIKey | IWZNLKUVIIFUOG-VURMDHGXSA-N |
| Mol Weight | 182.61 g/mol |
| Molecular Formula | C9H7ClO2 |
| Exact Mass | 182.013457 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GLxJCF6yeNR |
|---|---|
| Name | 2-Propenoic acid, 2-chloro-3-phenyl-, (Z)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 182.013457163 u |
| Formula | C9H7ClO2 |
| InChI | InChI=1S/C9H7ClO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-6H,(H,11,12)/b8-6- |
| InChIKey | IWZNLKUVIIFUOG-VURMDHGXSA-N |
| Molecular Weight | 182.606 g/mol |
| SMILES | C1=C(C=CC=C1)\C=C\(C(O)=O)Cl |