| SpectraBase Spectrum ID |
7r4jxMe8Ezj |
| Name |
Succinic acid, 3-(2-methoxyethyl)heptyl pentyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
344.256274254 u |
| Formula |
C19H36O5 |
| InChI |
InChI=1S/C19H36O5/c1-4-6-8-14-23-18(20)10-11-19(21)24-16-13-17(9-7-5-2)12-15-22-3/h17H,4-16H2,1-3H3 |
| InChIKey |
YBBNLGJMAJIRIH-UHFFFAOYSA-N |
| Molecular Weight |
344.492 g/mol |
| SMILES |
C(C(OCCC(CCCC)CCOC)=O)CC(OCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.977791 |
