| SpectraBase Compound ID | 3mCHerqUbSa |
|---|---|
| InChI | InChI=1S/C17H25F3O3/c1-10-13(14(21)23-15(22-10)16(2,3)4)9-11-5-7-12(8-6-11)17(18,19)20/h11-12,15H,5-9H2,1-4H3/t11?,12?,15-/m1/s1 |
| InChIKey | LGVJYCDOXVNNJM-KOHJWAIASA-N |
| Mol Weight | 334.38 g/mol |
| Molecular Formula | C17H25F3O3 |
| Exact Mass | 334.175579 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BaHxgtJ2Fjy |
|---|---|
| Name | (2R)-2-TERT.-BUTYL-5-(4'-TRIFLUOROMETHYLCYCLOHEXYL-METHYL)-6-METHYL-4H-1,3-DIOXIN-4-ONE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C17H25F3O3 |
| InChI | InChI=1S/C17H25F3O3/c1-10-13(14(21)23-15(22-10)16(2,3)4)9-11-5-7-12(8-6-11)17(18,19)20/h11-12,15H,5-9H2,1-4H3/t11?,12?,15-/m1/s1 |
| InChIKey | LGVJYCDOXVNNJM-KOHJWAIASA-N |
| Literature Reference Author | W.AMBERG,D.SEEBACH |
| Literature Reference Citation | CHEM.BER.,123,2429(1990) |
| Literature Reference DOI | 10.1002/cber.19901231226 |
| Molecular Weight | 334.379 g/mol |
| Solvent | Unknown |
| Source File Reference | UWED12114 |