| SpectraBase Compound ID | FdGYNIQePZI |
|---|---|
| InChI | InChI=1S/C12H12O2/c13-9-8-12(10-14-12)7-6-11-4-2-1-3-5-11/h1-5,13H,8-10H2 |
| InChIKey | QPGKEMPFXGHKGO-UHFFFAOYSA-N |
| Mol Weight | 188.23 g/mol |
| Molecular Formula | C12H12O2 |
| Exact Mass | 188.08373 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 5rJWibf6oKR |
|---|---|
| Name | 2-(2-Phenylethynyloxiranyl)ethanol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 188.083729624 u |
| Formula | C12H12O2 |
| InChI | InChI=1S/C12H12O2/c13-9-8-12(10-14-12)7-6-11-4-2-1-3-5-11/h1-5,13H,8-10H2 |
| InChIKey | QPGKEMPFXGHKGO-UHFFFAOYSA-N |
| Molecular Weight | 188.226 g/mol |
| SMILES | C(CC1(OC1)C#CC=1C=CC=CC1)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.902431 |