| SpectraBase Spectrum ID |
KSMy3EW9EC6 |
| Name |
Succinic acid, heptadecyl 5-methoxy-3-methylphenyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
470.397124834 u |
| Formula |
C28H54O5 |
| InChI |
InChI=1S/C28H54O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-32-27(29)19-20-28(30)33-25-22-26(2)21-24-31-3/h26H,4-25H2,1-3H3 |
| InChIKey |
LFYKGSHWCHVZPR-UHFFFAOYSA-N |
| Molecular Weight |
470.735 g/mol |
| SMILES |
C(CCOC(CCC(OCCC(CCOC)C)=O)=O)CCCCCCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.837664 |
