| SpectraBase Spectrum ID |
5bL0E3L3fTb |
| Name |
Adipic acid, ethyl 4-methoxy-2-methylbutyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
274.178023932 u |
| Formula |
C14H26O5 |
| InChI |
InChI=1S/C14H26O5/c1-4-18-13(15)7-5-6-8-14(16)19-11-12(2)9-10-17-3/h12H,4-11H2,1-3H3 |
| InChIKey |
UYRLOSIUYUFDLO-UHFFFAOYSA-N |
| Molecular Weight |
274.357 g/mol |
| SMILES |
C(C(=O)OCC(CCOC)C)CCCC(OCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.973039 |
