![1-Methyl-9-oxabicyclo[6.1.0]nonan-2-one](/api/spectrum/CAzUGJk1A2f/structure.png?h=300&w=458 "1-Methyl-9-oxabicyclo[6.1.0]nonan-2-one")
| SpectraBase Compound ID | 2lmzbRgJEJR |
|---|---|
| InChI | InChI=1S/C9H14O2/c1-9-7(10)5-3-2-4-6-8(9)11-9/h8H,2-6H2,1H3 |
| InChIKey | HNECOSTZJJSMIQ-UHFFFAOYSA-N |
| Mol Weight | 154.21 g/mol |
| Molecular Formula | C9H14O2 |
| Exact Mass | 154.09938 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | CAzUGJk1A2f |
|---|---|
| Name | 1-Methyl-9-oxabicyclo[6.1.0]nonan-2-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 154.099379689 u |
| Formula | C9H14O2 |
| InChI | InChI=1S/C9H14O2/c1-9-7(10)5-3-2-4-6-8(9)11-9/h8H,2-6H2,1H3 |
| InChIKey | HNECOSTZJJSMIQ-UHFFFAOYSA-N |
| Molecular Weight | 154.209 g/mol |
| SMILES | C1CCCCC2C(O2)(C1=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.981256 |