SpectraBase Spectrum ID |
BjOimaBXQ1E |
Name |
Glutaric acid, 2-ethoxyethyl isobutyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
260.162373868 u |
Formula |
C13H24O5 |
InChI |
InChI=1S/C13H24O5/c1-4-16-8-9-17-12(14)6-5-7-13(15)18-10-11(2)3/h11H,4-10H2,1-3H3 |
InChIKey |
NOPYXGVZQQODBQ-UHFFFAOYSA-N |
Molecular Weight |
260.330 g/mol |
SMILES |
CC(C)COC(CCCC(OCCOCC)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.823113 |