| SpectraBase Compound ID | 1lRfS5yhKJk |
|---|---|
| InChI | InChI=1S/C17H32O4/c1-4-7-10-15(6-3)14-21-17(19)12-9-11-16(18)20-13-8-5-2/h15H,4-14H2,1-3H3 |
| InChIKey | OTGAXTXRVFWUOQ-UHFFFAOYSA-N |
| Mol Weight | 300.4 g/mol |
| Molecular Formula | C17H32O4 |
| Exact Mass | 300.23006 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3verLT1oCdS |
|---|---|
| Name | Glutaric acid, butyl 2-ethylhexyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 300.230059506 u |
| Formula | C17H32O4 |
| InChI | InChI=1S/C17H32O4/c1-4-7-10-15(6-3)14-21-17(19)12-9-11-16(18)20-13-8-5-2/h15H,4-14H2,1-3H3 |
| InChIKey | OTGAXTXRVFWUOQ-UHFFFAOYSA-N |
| SMILES | CCCCOC(CCCC(OCC(CCCC)CC)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.919867 |