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4,4-DIMETHYL-2-(TRIFLUOROMETHYL)-BUTYROLACTONE
SpectraBase Compound ID J5j92JaCQ8y
InChI InChI=1S/C7H9F3O2/c1-6(2)3-4(5(11)12-6)7(8,9)10/h4H,3H2,1-2H3
InChIKey NSQKIHBAKTVICL-UHFFFAOYSA-N
Mol Weight 182.14 g/mol
Molecular Formula C7H9F3O2
Exact Mass 182.055464 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3hE0JihWhTG
Name 4,4-DIMETHYL-2-(TRIFLUOROMETHYL)-BUTYROLACTONE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H9F3O2
InChI InChI=1S/C7H9F3O2/c1-6(2)3-4(5(11)12-6)7(8,9)10/h4H,3H2,1-2H3
InChIKey NSQKIHBAKTVICL-UHFFFAOYSA-N
Literature Reference Author N.REINEKE,N.A.ZAIDI,M.MITRA,D.O'HAGAN,A.S.BATSANOV,J.A.K.HOW ARD,D.Y.NAUMOV
Literature Reference Citation J.CHEM.SOC.PERKIN-1,147(1996)
Literature Reference DOI 10.1039/p19960000147
Molecular Weight 182.142 g/mol
Solvent CDCl3
Source File Reference UWGE1603