| SpectraBase Spectrum ID |
6Oopnmhyfkq |
| Name |
Succinic acid, 2-ethylhexyl 3-phenylprop-2-en-1-yl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
346.214409442 u |
| Formula |
C21H30O4 |
| InChI |
InChI=1S/C21H30O4/c1-3-5-10-18(4-2)17-25-21(23)15-14-20(22)24-16-9-13-19-11-7-6-8-12-19/h6-9,11-13,18H,3-5,10,14-17H2,1-2H3/b13-9+ |
| InChIKey |
WHUBLDOSKSLKLR-UKTHLTGXSA-N |
| Molecular Weight |
346.467 g/mol |
| SMILES |
C(CC(OCC(CC)CCCC)=O)C(OC\C=C\C1=CC=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.96264 |
