| SpectraBase Spectrum ID |
P0rqVAFwrP |
| Name |
Succinic acid, 3-methylbutyl 3-methylbut-2-enyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
256.167459249 u |
| Formula |
C14H24O4 |
| InChI |
InChI=1S/C14H24O4/c1-11(2)7-9-17-13(15)5-6-14(16)18-10-8-12(3)4/h7,12H,5-6,8-10H2,1-4H3 |
| InChIKey |
IYCJIAJMFJQTIU-UHFFFAOYSA-N |
| Molecular Weight |
256.342 g/mol |
| SMILES |
CC(C)=CCOC(=O)CCC(OCCC(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.970439 |
