| SpectraBase Compound ID | 1NYbrEJ4w9l |
|---|---|
| InChI | InChI=1S/C9H16O3/c1-4-8(3)9(10)12-7-6-11-5-2/h4H,5-7H2,1-3H3/b8-4+ |
| InChIKey | FJCZBZZDDXIAHK-XBXARRHUSA-N |
| Mol Weight | 172.22 g/mol |
| Molecular Formula | C9H16O3 |
| Exact Mass | 172.109944 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 45wfHxhmpwV |
|---|---|
| Name | (E)-2-Ethoxyethyl 2-methylbut-2-enoate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 172.109944372 u |
| Formula | C9H16O3 |
| InChI | InChI=1S/C9H16O3/c1-4-8(3)9(10)12-7-6-11-5-2/h4H,5-7H2,1-3H3/b8-4+ |
| InChIKey | FJCZBZZDDXIAHK-XBXARRHUSA-N |
| Molecular Weight | 172.224 g/mol |
| SMILES | C(OCCOC(=O)\C(C)=C\C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.975147 |