| SpectraBase Compound ID | KdTWmcYaUV6 |
|---|---|
| InChI | InChI=1S/C12H20O3/c1-5-15-11(14)10-7-9(6-8(2)13)12(10,3)4/h9-10H,5-7H2,1-4H3/t9-,10-/m0/s1 |
| InChIKey | CJCOYZMAEANDNW-UWVGGRQHSA-N |
| Mol Weight | 212.29 g/mol |
| Molecular Formula | C12H20O3 |
| Exact Mass | 212.141245 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | GDayu9TtiK5 |
|---|---|
| Name | (1R,3R)-2,2-Dimethyl-3-(2-oxopropyl)-1-cyclobutanecarboxylic acid ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.141244501 u |
| Formula | C12H20O3 |
| InChI | InChI=1S/C12H20O3/c1-5-15-11(14)10-7-9(6-8(2)13)12(10,3)4/h9-10H,5-7H2,1-4H3/t9-,10-/m0/s1 |
| InChIKey | CJCOYZMAEANDNW-UWVGGRQHSA-N |
| Molecular Weight | 212.289 g/mol |
| SMILES | C1([C@](C(=O)OCC)(C[C@@]1(CC(=O)C)[H])[H])(C)C |