| SpectraBase Spectrum ID |
E3WpzCQdFf |
| Name |
1-(1-Methoxypropan-2-yloxy)propan-2-yl 2-methylbutanoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
232.167459249 u |
| Formula |
C12H24O4 |
| InChI |
InChI=1S/C12H24O4/c1-6-9(2)12(13)16-11(4)8-15-10(3)7-14-5/h9-11H,6-8H2,1-5H3 |
| InChIKey |
XINQQNKNHRDSPA-UHFFFAOYSA-N |
| Molecular Weight |
232.320 g/mol |
| SMILES |
COCC(OCC(OC(C(CC)C)=O)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.973647 |
