| SpectraBase Spectrum ID |
Dd8gOH0JbGX |
| Name |
Butanedioic acid, 2,2-dimethyl-, dibutyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
258.183109313 u |
| Formula |
C14H26O4 |
| InChI |
InChI=1S/C14H26O4/c1-5-7-9-17-12(15)11-14(3,4)13(16)18-10-8-6-2/h5-11H2,1-4H3 |
| InChIKey |
RIUSVSZVTHZZDR-UHFFFAOYSA-N |
| Molecular Weight |
258.358 g/mol |
| SMILES |
C(C(=O)OCCCC)(CC(=O)OCCCC)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.989727 |
