| SpectraBase Compound ID | KchDnegax6S |
|---|---|
| InChI | InChI=1S/C11H12O2/c1-8(2)9-4-6-10(7-5-9)11(12)13-3/h4-7H,1H2,2-3H3 |
| InChIKey | OVVNOSFHLSEYEP-UHFFFAOYSA-N |
| Mol Weight | 176.21 g/mol |
| Molecular Formula | C11H12O2 |
| Exact Mass | 176.08373 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | DZjD8JEc90Q |
|---|---|
| Name | 4-Methoxycarbonyl-alpha-methyl-styrene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 176.083729624 u |
| Formula | C11H12O2 |
| InChI | InChI=1S/C11H12O2/c1-8(2)9-4-6-10(7-5-9)11(12)13-3/h4-7H,1H2,2-3H3 |
| InChIKey | OVVNOSFHLSEYEP-UHFFFAOYSA-N |
| Molecular Weight | 176.215 g/mol |
| SMILES | C(=O)(C1=CC=C(C(=C)C)C=C1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.865602 |