SpectraBase Spectrum ID |
36TbJt885Aa |
Name |
Glutaric acid, ethyl tetrahydrofurfuryl ester |
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/c1-2-15-11(13)6-3-7-12(14)17-9-10-5-4-8-16-10/h10H,2-9H2,1H3 |
InChIKey |
UYGAHFRVFALUEJ-UHFFFAOYSA-N |
Molecular Weight |
244.287 g/mol |
SMILES |
C1CCC(O1)COC(CCCC(OCC)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.967931 |