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5-(PARA-CYANO-PHENYL)-3-PHENYL-ISOXAZOLE

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5-(PARA-CYANO-PHENYL)-3-PHENYL-ISOXAZOLE
SpectraBase Compound ID HHoRwHWY2Iv
InChI InChI=1S/C16H10N2O/c17-11-12-6-8-14(9-7-12)16-10-15(18-19-16)13-4-2-1-3-5-13/h1-10H
InChIKey WTLKWFCKLANCEC-UHFFFAOYSA-N
Mol Weight 246.27 g/mol
Molecular Formula C16H10N2O
Exact Mass 246.079313 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EWFD73O78v4
Name 3-Phenyl-5-(4-cyanophenyl)-isoxazole
CAS Registry Number 79182-05-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H10N2O
InChI InChI=1S/C16H10N2O/c17-11-12-6-8-14(9-7-12)16-10-15(18-19-16)13-4-2-1-3-5-13/h1-10H
InChIKey WTLKWFCKLANCEC-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