| SpectraBase Spectrum ID |
FsBbmHAjDz9 |
| Name |
4-(Methoxycarbonyl)-2-[1'-formyl-1'-propenyl]-4,4-dimethoxybutane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
244.131073739 u |
| Formula |
C12H20O5 |
| InChI |
InChI=1S/C12H20O5/c1-6-10(8-13)9(2)7-12(16-4,17-5)11(14)15-3/h6,8-9H,7H2,1-5H3/b10-6+ |
| InChIKey |
AHZGVGZQVWRUPP-UXBLZVDNSA-N |
| Molecular Weight |
244.287 g/mol |
| SMILES |
CC(CC(OC)(OC)C(=O)OC)\C(=C\C)C=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.906881 |
![4-(Methoxycarbonyl)-2-[1'-formyl-1'-propenyl]-4,4-dimethoxybutane](/api/spectrum/FsBbmHAjDz9/structure.png?h=300&w=458 "4-(Methoxycarbonyl)-2-[1'-formyl-1'-propenyl]-4,4-dimethoxybutane")
