| SpectraBase Compound ID | ElRlAV7s6Te |
|---|---|
| InChI | InChI=1S/C10H9ClO2/c11-8-3-5-9(6-4-8)13-10(12)7-1-2-7/h3-7H,1-2H2 |
| InChIKey | VDWGAQSMDCDWER-UHFFFAOYSA-N |
| Mol Weight | 196.63 g/mol |
| Molecular Formula | C10H9ClO2 |
| Exact Mass | 196.029107 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2C6g6ZiCkPO |
|---|---|
| Name | Cyclopropanecarboxylic acid, 4-chlorophenyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.029107228 u |
| Formula | C10H9ClO2 |
| InChI | InChI=1S/C10H9ClO2/c11-8-3-5-9(6-4-8)13-10(12)7-1-2-7/h3-7H,1-2H2 |
| InChIKey | VDWGAQSMDCDWER-UHFFFAOYSA-N |
| Molecular Weight | 196.633 g/mol |
| SMILES | C(=O)(OC1=CC=C(C=C1)Cl)C1CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.942266 |