![2-Cyclohexen-1-one, 5-[(methoxymethoxy)methyl]-, (.+-.)-](/api/spectrum/9DQqyPxTVCs/structure.png?h=300&w=458 "2-Cyclohexen-1-one, 5-[(methoxymethoxy)methyl]-, (.+-.)-")
| SpectraBase Compound ID | D19FttWqQNJ |
|---|---|
| InChI | InChI=1S/C9H14O3/c1-11-7-12-6-8-3-2-4-9(10)5-8/h2,4,8H,3,5-7H2,1H3 |
| InChIKey | ZFGJUAHIBWWQDN-UHFFFAOYSA-N |
| Mol Weight | 170.21 g/mol |
| Molecular Formula | C9H14O3 |
| Exact Mass | 170.094294 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 9DQqyPxTVCs |
|---|---|
| Name | 2-Cyclohexen-1-one, 5-[(methoxymethoxy)methyl]-, (.+-.)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 170.094294308 u |
| Formula | C9H14O3 |
| InChI | InChI=1S/C9H14O3/c1-11-7-12-6-8-3-2-4-9(10)5-8/h2,4,8H,3,5-7H2,1H3 |
| InChIKey | ZFGJUAHIBWWQDN-UHFFFAOYSA-N |
| Molecular Weight | 170.208 g/mol |
| SMILES | C1(C=CCC(C1)COCOC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.866727 |