| SpectraBase Spectrum ID |
22jXIMHTtjz |
| Name |
Dimethylmalonic acid, butyl pentadecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
398.339609957 u |
| Formula |
C24H46O4 |
| InChI |
InChI=1S/C24H46O4/c1-5-7-9-10-11-12-13-14-15-16-17-18-19-21-28-23(26)24(3,4)22(25)27-20-8-6-2/h5-21H2,1-4H3 |
| InChIKey |
TZMUTZOWQWGQDQ-UHFFFAOYSA-N |
| Molecular Weight |
398.628 g/mol |
| SMILES |
CCCCOC(C(C(=O)OCCCCCCCCCCCCCCC)(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.854357 |
