![4-[1,3]Dioxolan-2-yl-butyric acid e](/api/spectrum/8IzFad8xc9B/structure.png?h=300&w=458 "4-[1,3]Dioxolan-2-yl-butyric acid e")
| SpectraBase Compound ID | C8F6Enot7eh |
|---|---|
| InChI | InChI=1S/C9H16O4/c1-2-11-8(10)4-3-5-9-12-6-7-13-9/h9H,2-7H2,1H3 |
| InChIKey | PSAZZBRAHGUHNN-UHFFFAOYSA-N |
| Mol Weight | 188.22 g/mol |
| Molecular Formula | C9H16O4 |
| Exact Mass | 188.104859 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8IzFad8xc9B |
|---|---|
| Name | 4-[1,3]Dioxolan-2-yl-butyric acid E |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 188.104858991 u |
| Formula | C9H16O4 |
| InChI | InChI=1S/C9H16O4/c1-2-11-8(10)4-3-5-9-12-6-7-13-9/h9H,2-7H2,1H3 |
| InChIKey | PSAZZBRAHGUHNN-UHFFFAOYSA-N |
| Molecular Weight | 188.223 g/mol |
| SMILES | C(=O)(OCC)CCCC1OCCO1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.989246 |