| SpectraBase Spectrum ID |
1DFevFKz6yp |
| Name |
Butanedioic acid, 2-(1-methoxy-1-methylethoxy)-3-methyl-, diethyl ester, [S-(R*,S*)]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
276.157288487 u |
| Formula |
C13H24O6 |
| InChI |
InChI=1S/C13H24O6/c1-7-17-11(14)9(3)10(12(15)18-8-2)19-13(4,5)16-6/h9-10H,7-8H2,1-6H3 |
| InChIKey |
CZWLZNHQNLVANY-UHFFFAOYSA-N |
| Molecular Weight |
276.329 g/mol |
| SMILES |
CC(OC(C(C(=O)OCC)C)C(=O)OCC)(OC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.966819 |
![Butanedioic acid, 2-(1-methoxy-1-methylethoxy)-3-methyl-, diethyl ester, [S-(R*,S*)]-](/api/spectrum/1DFevFKz6yp/structure.png?h=300&w=458 "Butanedioic acid, 2-(1-methoxy-1-methylethoxy)-3-methyl-, diethyl ester, [S-(R*,S*)]-")
