| SpectraBase Compound ID | 2tHcfRaProd |
|---|---|
| InChI | InChI=1S/C10H11ClO3/c1-2-7-13-10(12)14-9-5-3-8(11)4-6-9/h3-6H,2,7H2,1H3 |
| InChIKey | XZSUTTPOKOGVNJ-UHFFFAOYSA-N |
| Mol Weight | 214.65 g/mol |
| Molecular Formula | C10H11ClO3 |
| Exact Mass | 214.039672 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | JIr9sbW9LfB |
|---|---|
| Name | Carbonic acid, propyl 4-chlorophenyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 214.039671911 u |
| Formula | C10H11ClO3 |
| InChI | InChI=1S/C10H11ClO3/c1-2-7-13-10(12)14-9-5-3-8(11)4-6-9/h3-6H,2,7H2,1H3 |
| InChIKey | XZSUTTPOKOGVNJ-UHFFFAOYSA-N |
| Molecular Weight | 214.648 g/mol |
| SMILES | C(C)COC(=O)OC1=CC=C(C=C1)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.916066 |