| SpectraBase Spectrum ID |
AMjZUq9KKdN |
| Name |
Succinic acid, 8-chlorooctyl 3-methylbut-3-en-1-yl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
332.175437110 u |
| Formula |
C17H29ClO4 |
| InChI |
InChI=1S/C17H29ClO4/c1-15(2)11-14-22-17(20)10-9-16(19)21-13-8-6-4-3-5-7-12-18/h1,3-14H2,2H3 |
| InChIKey |
FCOVUAUGPFVYFC-UHFFFAOYSA-N |
| Molecular Weight |
332.868 g/mol |
| SMILES |
C(CC(OCCCCCCCCCl)=O)C(OCCC(C)=C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.912906 |
