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(R)-5,5,5-TRIFLUORO-3-METHYLPENTANOIC-ACID
SpectraBase Compound ID 1yEIWUObnTa
InChI InChI=1S/C6H9F3O2/c1-4(2-5(10)11)3-6(7,8)9/h4H,2-3H2,1H3,(H,10,11)/t4-/m1/s1
InChIKey XPBDETVICWHQIA-SCSAIBSYSA-N
Mol Weight 170.13 g/mol
Molecular Formula C6H9F3O2
Exact Mass 170.055464 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JXXHBJOWVJ8
Name (R)-5,5,5-TRIFLUORO-3-METHYLPENTANOIC-ACID
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H9F3O2
InChI InChI=1S/C6H9F3O2/c1-4(2-5(10)11)3-6(7,8)9/h4H,2-3H2,1H3,(H,10,11)/t4-/m1/s1
InChIKey XPBDETVICWHQIA-SCSAIBSYSA-N
Literature Reference Author H.ERDBRINK,E.K.NYAKATURA,S.HUHMANN,U.I.M.GERLING,D.LENTZ,B.K OKSCH,C.CZEKELIUS
Literature Reference Citation BEIL.J.ORG.CHEM.,9,2009(2013)
Literature Reference DOI 10.3762/bjoc.9.236
Molecular Weight 170.131 g/mol
Solvent CDCl3
Source File Reference UWLU77562