| SpectraBase Compound ID | HbOof9liLrz |
|---|---|
| InChI | InChI=1S/C10H10O3/c1-8(13-10(11)12-2)9-6-4-3-5-7-9/h3-7H,1H2,2H3 |
| InChIKey | AAFNDMADGOHQQT-UHFFFAOYSA-N |
| Mol Weight | 178.19 g/mol |
| Molecular Formula | C10H10O3 |
| Exact Mass | 178.062994 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | JkaKMG9RDLO |
|---|---|
| Name | Methyl 1-phenylethenyl carbonate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 178.062994179 u |
| Formula | C10H10O3 |
| InChI | InChI=1S/C10H10O3/c1-8(13-10(11)12-2)9-6-4-3-5-7-9/h3-7H,1H2,2H3 |
| InChIKey | AAFNDMADGOHQQT-UHFFFAOYSA-N |
| Molecular Weight | 178.187 g/mol |
| SMILES | C(OC(=C)C=1C=CC=CC1)(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.933134 |