| SpectraBase Spectrum ID |
G3vtykl0lcn |
| Name |
Succinic acid, 2-ethylhexyl neryl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
366.277009700 u |
| Formula |
C22H38O4 |
| InChI |
InChI=1S/C22H38O4/c1-6-8-12-20(7-2)17-26-22(24)14-13-21(23)25-16-15-19(5)11-9-10-18(3)4/h10,15,20H,6-9,11-14,16-17H2,1-5H3/b19-15- |
| InChIKey |
JRYFMNHVDFYNJA-CYVLTUHYSA-N |
| Molecular Weight |
366.542 g/mol |
| SMILES |
C(CC(OCC(CC)CCCC)=O)C(OC\C=C/(CCC=C(C)C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.974715 |
