| SpectraBase Spectrum ID |
4BHFz743Ht |
| Name |
Succinic acid, heptadecyl 3-(2-methoxyethyl)heptyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
512.444075027 u |
| Formula |
C31H60O5 |
| InChI |
InChI=1S/C31H60O5/c1-4-6-8-9-10-11-12-13-14-15-16-17-18-19-20-26-35-30(32)22-23-31(33)36-28-25-29(21-7-5-2)24-27-34-3/h29H,4-28H2,1-3H3 |
| InChIKey |
DYPIFQAIWSRPTF-UHFFFAOYSA-N |
| Molecular Weight |
512.816 g/mol |
| SMILES |
C(C(OCCC(CCCC)CCOC)=O)CC(OCCCCCCCCCCCCCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.862733 |
