| SpectraBase Spectrum ID |
Jo7NAiHAJJp |
| Name |
Succinic acid, dodec-2-en-1-yl 2-heptyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
382.308309828 u |
| Formula |
C23H42O4 |
| InChI |
InChI=1S/C23H42O4/c1-4-6-8-9-10-11-12-13-14-16-20-26-22(24)18-19-23(25)27-21(3)17-15-7-5-2/h14,16,21H,4-13,15,17-20H2,1-3H3/b16-14+ |
| InChIKey |
FYKKCFZPEQBRJM-JQIJEIRASA-N |
| Molecular Weight |
382.585 g/mol |
| SMILES |
C(CC(OC\C=C\CCCCCCCCC)=O)C(OC(CCCCC)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.928799 |
