| SpectraBase Compound ID | GQz4wF3CJtN |
|---|---|
| InChI | InChI=1S/C11H12O3/c1-13-10-5-3-4-9(8-10)6-7-11(12)14-2/h3-8H,1-2H3/b7-6+ |
| InChIKey | NDMAAKFMVKZYIV-VOTSOKGWSA-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 | MoYVXX1apU |
|---|---|
| Name | Methyl 3-(3-methoxyphenyl)prop-2-enoate |
| 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/c1-13-10-5-3-4-9(8-10)6-7-11(12)14-2/h3-8H,1-2H3/b7-6+ |
| InChIKey | NDMAAKFMVKZYIV-VOTSOKGWSA-N |
| Molecular Weight | 192.214 g/mol |
| SMILES | C(\C=C\C1=CC=CC(OC)=C1)(OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.903441 |