| SpectraBase Spectrum ID |
CxVYyuuy8Tj |
| Name |
Fumaric acid, cyclobutyl decyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
310.214409442 u |
| Formula |
C18H30O4 |
| InChI |
InChI=1S/C18H30O4/c1-2-3-4-5-6-7-8-9-15-21-17(19)13-14-18(20)22-16-11-10-12-16/h13-14,16H,2-12,15H2,1H3/b14-13+ |
| InChIKey |
QXQMTZMORPISBS-BUHFOSPRSA-N |
| SMILES |
C1(CCC1)OC(\C=C\C(OCCCCCCCCCC)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.881739 |
