SpectraBase Spectrum ID |
4YyAp8Dc5ln |
Name |
Succinic acid, 2-decyl 3-methylbutyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
328.261359635 u |
Formula |
C19H36O4 |
InChI |
InChI=1S/C19H36O4/c1-5-6-7-8-9-10-11-17(4)23-19(21)13-12-18(20)22-15-14-16(2)3/h16-17H,5-15H2,1-4H3 |
InChIKey |
DASNNCVOCLVLNS-UHFFFAOYSA-N |
Molecular Weight |
328.493 g/mol |
SMILES |
CCCCCCCCC(OC(=O)CCC(OCCC(C)C)=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.919594 |