| SpectraBase Compound ID | BWDrf6SZKGP |
|---|---|
| InChI | InChI=1S/C7H14O2/c1-3-6(8)7(4-2)5-9-7/h6,8H,3-5H2,1-2H3/t6-,7+/m0/s1 |
| InChIKey | ORQVPVZPLXCUIB-NKWVEPMBSA-N |
| Mol Weight | 130.19 g/mol |
| Molecular Formula | C7H14O2 |
| Exact Mass | 130.09938 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | DJCDXoQE1NV |
|---|---|
| Name | 1,2-Epoxy-2-ethylpentan-3-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 130.099379689 u |
| Formula | C7H14O2 |
| InChI | InChI=1S/C7H14O2/c1-3-6(8)7(4-2)5-9-7/h6,8H,3-5H2,1-2H3/t6-,7+/m0/s1 |
| InChIKey | ORQVPVZPLXCUIB-NKWVEPMBSA-N |
| Molecular Weight | 130.187 g/mol |
| SMILES | [C@@]1(OC1)([C@@](O)(CC)[H])CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.980877 |