| SpectraBase Spectrum ID |
A99xPsnJbyW |
| Name |
Propanedioic acid, (4,4-dimethoxybutyl)-, dimethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
248.125988358 u |
| Formula |
C11H20O6 |
| InChI |
InChI=1S/C11H20O6/c1-14-9(15-2)7-5-6-8(10(12)16-3)11(13)17-4/h8-9H,5-7H2,1-4H3 |
| InChIKey |
CIFVTCCFEUKNQP-UHFFFAOYSA-N |
| Molecular Weight |
248.275 g/mol |
| SMILES |
C(C(=O)OC)(C(=O)OC)CCCC(OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.912683 |
