| SpectraBase Compound ID | 5gvWPckE3u |
|---|---|
| InChI | InChI=1S/C11H14O3/c1-8(2)9-4-6-10(7-5-9)14-11(12)13-3/h4-8H,1-3H3 |
| InChIKey | UOSHSOCAFAHKNH-UHFFFAOYSA-N |
| Mol Weight | 194.23 g/mol |
| Molecular Formula | C11H14O3 |
| Exact Mass | 194.094294 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | I4aKamRXlSv |
|---|---|
| Name | Carbonic acid, 4-isopropylphenyl methyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.094294308 u |
| Formula | C11H14O3 |
| InChI | InChI=1S/C11H14O3/c1-8(2)9-4-6-10(7-5-9)14-11(12)13-3/h4-8H,1-3H3 |
| InChIKey | UOSHSOCAFAHKNH-UHFFFAOYSA-N |
| Molecular Weight | 194.230 g/mol |
| SMILES | C(OC)(=O)OC1=CC=C(C(C)C)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.955055 |