| SpectraBase Compound ID | 6fFVoi7u1xq |
|---|---|
| InChI | InChI=1S/C10H10O2/c1-2-4-8-7(3-1)9-5-6-10(11-8)12-9/h1-4,9-10H,5-6H2 |
| InChIKey | CABHJFOJMVZLEH-UHFFFAOYSA-N |
| Mol Weight | 162.19 g/mol |
| Molecular Formula | C10H10O2 |
| Exact Mass | 162.06808 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | AAnMeSGFCLq |
|---|---|
| Name | 2,3,4,5-Tetrahydro-2,5-epoxy-1-benzoxepin |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 162.068079560 u |
| Formula | C10H10O2 |
| InChI | InChI=1S/C10H10O2/c1-2-4-8-7(3-1)9-5-6-10(11-8)12-9/h1-4,9-10H,5-6H2 |
| InChIKey | CABHJFOJMVZLEH-UHFFFAOYSA-N |
| Molecular Weight | 162.188 g/mol |
| SMILES | C=12OC3OC(C2=CC=CC1)CC3 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.909196 |