![2-Ethyl-7-oxa-bicyclo[4.1.0]heptane](/api/spectrum/FQYKpiU5yw7/structure.png?h=300&w=458 "2-Ethyl-7-oxa-bicyclo[4.1.0]heptane")
| SpectraBase Compound ID | L2GSMI7PKZ2 |
|---|---|
| InChI | InChI=1S/C8H14O/c1-2-6-4-3-5-7-8(6)9-7/h6-8H,2-5H2,1H3 |
| InChIKey | HEHBHCRLIYBRAN-UHFFFAOYSA-N |
| Mol Weight | 126.2 g/mol |
| Molecular Formula | C8H14O |
| Exact Mass | 126.104465 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | FQYKpiU5yw7 |
|---|---|
| Name | 2-Ethyl-7-oxa-bicyclo[4.1.0]heptane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 126.104465070 u |
| Formula | C8H14O |
| InChI | InChI=1S/C8H14O/c1-2-6-4-3-5-7-8(6)9-7/h6-8H,2-5H2,1H3 |
| InChIKey | HEHBHCRLIYBRAN-UHFFFAOYSA-N |
| Molecular Weight | 126.199 g/mol |
| SMILES | C12C(CCCC1O2)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.89675 |