| SpectraBase Spectrum ID |
42AdbRPn8MU |
| Name |
Succinic acid, 3-methylbut-2-yl 2-methylbutyl 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/c1-6-11(4)9-17-13(15)7-8-14(16)18-12(5)10(2)3/h10-12H,6-9H2,1-5H3 |
| InChIKey |
PEPSXTRFYJMITR-UHFFFAOYSA-N |
| Molecular Weight |
258.358 g/mol |
| SMILES |
C(CC(OC(C(C)C)C)=O)C(OCC(CC)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.97368 |
