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5-PHENYL-4-(TRIFLUOROMETHYL)-3-(4-TRIFLUOROMETHYL)-PHENYL-ISOXAZOLE
SpectraBase Compound ID FrOaVAnAKmn
InChI InChI=1S/C17H9F6NO/c18-16(19,20)12-8-6-10(7-9-12)14-13(17(21,22)23)15(25-24-14)11-4-2-1-3-5-11/h1-9H
InChIKey XYYODDSQQPFCGP-UHFFFAOYSA-N
Mol Weight 357.26 g/mol
Molecular Formula C17H9F6NO
Exact Mass 357.058833 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IlKCBALDuMu
Name 5-PHENYL-4-(TRIFLUOROMETHYL)-3-(4-TRIFLUOROMETHYL)-PHENYL-ISOXAZOLE
Compound Number 4G
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H9F6NO
InChI InChI=1S/C17H9F6NO/c18-16(19,20)12-8-6-10(7-9-12)14-13(17(21,22)23)15(25-24-14)11-4-2-1-3-5-11/h1-9H
InChIKey XYYODDSQQPFCGP-UHFFFAOYSA-N
Literature Reference Author B.C.HAMPER,K.L.LESCHINSKY
Literature Reference Citation J.HETCYCL.CHEM.,40,575(2003)
Literature Reference DOI 10.1002/jhet.5570400404
Molecular Weight 357.255 g/mol
Solvent CDCl3
Source File Reference UWMS22618