SpectraBase Spectrum ID |
5jxI5Zx2hCE |
Name |
Succinic acid, 3-methylbut-2-en-1-yl hex-5-en-1-yl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
268.167459249 u |
Formula |
C15H24O4 |
InChI |
InChI=1S/C15H24O4/c1-4-5-6-7-11-18-14(16)8-9-15(17)19-12-10-13(2)3/h4,10H,1,5-9,11-12H2,2-3H3 |
InChIKey |
BEQVBLRBMJNWSE-UHFFFAOYSA-N |
Molecular Weight |
268.353 g/mol |
SMILES |
C(CC(OCC=C(C)C)=O)C(OCCCCC=C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.877621 |