SpectraBase Compound ID | CygqbP1ePIC |
---|---|
InChI | InChI=1S/C13H24O6/c1-3-16-8-10-18-12(14)6-5-7-13(15)19-11-9-17-4-2/h3-11H2,1-2H3 |
InChIKey | PMMQYPRIEGHPSP-UHFFFAOYSA-N |
Mol Weight | 276.33 g/mol |
Molecular Formula | C13H24O6 |
Exact Mass | 276.157288 g/mol |
SpectraBase Spectrum ID | 9jYOzPDFoph |
---|---|
Name | Glutaric 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 | 276.157288487 u |
Formula | C13H24O6 |
InChI | InChI=1S/C13H24O6/c1-3-16-8-10-18-12(14)6-5-7-13(15)19-11-9-17-4-2/h3-11H2,1-2H3 |
InChIKey | PMMQYPRIEGHPSP-UHFFFAOYSA-N |
Molecular Weight | 276.329 g/mol |
SMILES | CCOCCOC(CCCC(OCCOCC)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.98604 |