| SpectraBase Compound ID | 9e97HTHPqrx |
|---|---|
| InChI | InChI=1S/C10H12O/c1-2-4-9(5-3-1)6-7-10-8-11-10/h1-5,10H,6-8H2 |
| InChIKey | JVGAGAVQROERFI-UHFFFAOYSA-N |
| Mol Weight | 148.2 g/mol |
| Molecular Formula | C10H12O |
| Exact Mass | 148.088815 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | H9nWan8bzzU |
|---|---|
| Name | 2-(2-Phenylethyl)oxirane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 148.088815005 u |
| Formula | C10H12O |
| InChI | InChI=1S/C10H12O/c1-2-4-9(5-3-1)6-7-10-8-11-10/h1-5,10H,6-8H2 |
| InChIKey | JVGAGAVQROERFI-UHFFFAOYSA-N |
| Molecular Weight | 148.205 g/mol |
| SMILES | C1(OC1)CCC1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.841163 |