![2-[3'-(1"-Hydroxy-1"-methylethyl)-2',2'-dimethylcyclobutyl] ethanal](/api/spectrum/JRSfq4ulwwt/structure.png?h=300&w=458 "2-[3'-(1\"-Hydroxy-1\"-methylethyl)-2',2'-dimethylcyclobutyl] ethanal")
| SpectraBase Compound ID | 4SbOhklutCW |
|---|---|
| InChI | InChI=1S/C11H20O2/c1-10(2)8(5-6-12)7-9(10)11(3,4)13/h6,8-9,13H,5,7H2,1-4H3 |
| InChIKey | QQQIBQYSOJCDIO-UHFFFAOYSA-N |
| Mol Weight | 184.28 g/mol |
| Molecular Formula | C11H20O2 |
| Exact Mass | 184.14633 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JRSfq4ulwwt |
|---|---|
| Name | 2-[3'-(1''-Hydroxy-1''-methylethyl)-2',2'-dimethylcyclobutyl] ethanal |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 184.146329882 u |
| Formula | C11H20O2 |
| InChI | InChI=1S/C11H20O2/c1-10(2)8(5-6-12)7-9(10)11(3,4)13/h6,8-9,13H,5,7H2,1-4H3 |
| InChIKey | QQQIBQYSOJCDIO-UHFFFAOYSA-N |
| Molecular Weight | 184.279 g/mol |
| SMILES | C1(C(C)(C)C(C1)CC=O)C(O)(C)C |