| SpectraBase Spectrum ID |
6qxPPh0JD7E |
| Name |
(2S,3R,4R)-2,4-Dimethyl-5-oxotetrahydrofuran-3-yl 2-ethylbutanoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
228.136159120 u |
| Formula |
C12H20O4 |
| InChI |
InChI=1S/C12H20O4/c1-5-9(6-2)12(14)16-10-7(3)11(13)15-8(10)4/h7-10H,5-6H2,1-4H3/t7-,8+,10-/m1/s1 |
| InChIKey |
FTILHSUFCOBGST-KHQFGBGNSA-N |
| Molecular Weight |
228.288 g/mol |
| SMILES |
C1(O[C@]([C@@]([C@]1(C)[H])(OC(C(CC)CC)=O)[H])(C)[H])=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.923907 |
