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3-(PARA-TRIFLUORMETHYL-PHENYL)-5-PHENYL-ISOXAZOLE
SpectraBase Compound ID 9U1hfbCb7Nk
InChI InChI=1S/C16H10F3NO/c17-16(18,19)13-8-6-11(7-9-13)14-10-15(21-20-14)12-4-2-1-3-5-12/h1-10H
InChIKey AXTZGAJWSXQYNC-UHFFFAOYSA-N
Mol Weight 289.26 g/mol
Molecular Formula C16H10F3NO
Exact Mass 289.071448 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FHRf0e4VQpT
Name 3-(4-Trifluoromethyl-phenyl)-5-phenyl-isoxazole
CAS Registry Number 79182-01-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H10F3NO
InChI InChI=1S/C16H10F3NO/c17-16(18,19)13-8-6-11(7-9-13)14-10-15(21-20-14)12-4-2-1-3-5-12/h1-10H
InChIKey AXTZGAJWSXQYNC-UHFFFAOYSA-N
Instrument Name Jeol FX-60
Literature Reference D.R. Chrisope, R.A. Keel, J. Heterocycl. Chem. 18, 795 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6