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2,5-DIMETHYL-BENZOTRIFLUORIDE

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2,5-DIMETHYL-BENZOTRIFLUORIDE
SpectraBase Compound ID G8XQuq8av24
InChI InChI=1S/C9H9F3/c1-6-3-4-7(2)8(5-6)9(10,11)12/h3-5H,1-2H3
InChIKey RIKQFBGCNQAHBO-UHFFFAOYSA-N
Mol Weight 174.17 g/mol
Molecular Formula C9H9F3
Exact Mass 174.065635 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LfnXfcFNCKD
Name 2,5-DIMETHYL-BENZOTRIFLUORIDE
Compound Number 8-2,5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H9F3
InChI InChI=1S/C9H9F3/c1-6-3-4-7(2)8(5-6)9(10,11)12/h3-5H,1-2H3
InChIKey RIKQFBGCNQAHBO-UHFFFAOYSA-N
Literature Reference Author D.DECOSTA,J.PINCOCK
Literature Reference Citation J.ORG.CHEM.,67,9484(2002)
Literature Reference DOI 10.1021/jo0205715
Molecular Weight 174.166 g/mol
Solvent CDCl3
Source File Reference UWMS25356