SpectraBase Spectrum ID |
JTQZTH0fy7L |
Name |
Succinic acid, 3-methylbut-2-yl 2-ethoxyethyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
260.162373868 u |
Formula |
C13H24O5 |
InChI |
InChI=1S/C13H24O5/c1-5-16-8-9-17-12(14)6-7-13(15)18-11(4)10(2)3/h10-11H,5-9H2,1-4H3 |
InChIKey |
QNGRAUDASVLTOS-UHFFFAOYSA-N |
Molecular Weight |
260.330 g/mol |
SMILES |
C(CC(OC(C(C)C)C)=O)C(OCCOCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.934817 |