| SpectraBase Compound ID | 1MC1m1xSGXN |
|---|---|
| InChI | InChI=1S/C7H12O4/c1-4-6(7(8)10-3)11-5-9-2/h4,6H,1,5H2,2-3H3 |
| InChIKey | PGDGVKLMMUQXKN-UHFFFAOYSA-N |
| Mol Weight | 160.17 g/mol |
| Molecular Formula | C7H12O4 |
| Exact Mass | 160.073559 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | H6UBJMY3C9Y |
|---|---|
| Name | 2-(Methoxymethoxy)-3-butenoic acid methyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 160.073558862 u |
| Formula | C7H12O4 |
| InChI | InChI=1S/C7H12O4/c1-4-6(7(8)10-3)11-5-9-2/h4,6H,1,5H2,2-3H3 |
| InChIKey | PGDGVKLMMUQXKN-UHFFFAOYSA-N |
| Molecular Weight | 160.169 g/mol |
| SMILES | C(=O)(C(C=C)OCOC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.90759 |