| SpectraBase Spectrum ID |
12HOHYdgMu5 |
| Name |
Succinic acid, 3-methylbut-2-yl 2-methoxyethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
246.146723803 u |
| Formula |
C12H22O5 |
| InChI |
InChI=1S/C12H22O5/c1-9(2)10(3)17-12(14)6-5-11(13)16-8-7-15-4/h9-10H,5-8H2,1-4H3 |
| InChIKey |
KWGDYNAFAFLTHI-UHFFFAOYSA-N |
| Molecular Weight |
246.303 g/mol |
| SMILES |
C(CC(OC(C(C)C)C)=O)C(OCCOC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.978641 |
