| SpectraBase Compound ID | LiRu9gXGfaZ |
|---|---|
| InChI | InChI=1S/C11H12O3/c1-13-9-4-2-8(3-5-9)11(12)14-10-6-7-10/h2-5,10H,6-7H2,1H3 |
| InChIKey | RQCPLSDNOHJGAH-UHFFFAOYSA-N |
| Mol Weight | 192.21 g/mol |
| Molecular Formula | C11H12O3 |
| Exact Mass | 192.078644 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | APkJHNoo7rb |
|---|---|
| Name | 4-Methoxy-benzoic acid cyclopropyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 192.078644243 u |
| Formula | C11H12O3 |
| InChI | InChI=1S/C11H12O3/c1-13-9-4-2-8(3-5-9)11(12)14-10-6-7-10/h2-5,10H,6-7H2,1H3 |
| InChIKey | RQCPLSDNOHJGAH-UHFFFAOYSA-N |
| Molecular Weight | 192.214 g/mol |
| SMILES | C=1(C(OC2CC2)=O)C=CC(=CC1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.954763 |