SpectraBase Spectrum ID |
FvLW1kgR4Qf |
Name |
Fumaric acid, di(2-ethoxyethyl) ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
260.125988358 u |
Formula |
C12H20O6 |
InChI |
InChI=1S/C12H20O6/c1-3-15-7-9-17-11(13)5-6-12(14)18-10-8-16-4-2/h5-6H,3-4,7-10H2,1-2H3/b6-5+ |
InChIKey |
FAOJZHMRXJJQCB-AATRIKPKSA-N |
Molecular Weight |
260.286 g/mol |
SMILES |
C(OCCOC(\C=C\C(=O)OCCOCC)=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.976839 |