| SpectraBase Compound ID | JlzLEN52iYL |
|---|---|
| InChI | InChI=1S/C16H30O4/c1-4-7-10-14(6-3)20-16(18)12-9-11-15(17)19-13-8-5-2/h14H,4-13H2,1-3H3 |
| InChIKey | OGIFACWDKXJMLK-UHFFFAOYSA-N |
| Mol Weight | 286.41 g/mol |
| Molecular Formula | C16H30O4 |
| Exact Mass | 286.214409 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 5FFP4QK8NXc |
|---|---|
| Name | Glutaric acid, butyl 3-heptyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 286.214409442 u |
| Formula | C16H30O4 |
| InChI | InChI=1S/C16H30O4/c1-4-7-10-14(6-3)20-16(18)12-9-11-15(17)19-13-8-5-2/h14H,4-13H2,1-3H3 |
| InChIKey | OGIFACWDKXJMLK-UHFFFAOYSA-N |
| SMILES | CCC(OC(CCCC(OCCCC)=O)=O)CCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.9223 |