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3-Phenyl-5-(3-phenyl-2-isoxazolin-5-yl)isoxazole
SpectraBase Compound ID B6HUFYOKYO9
InChI InChI=1S/C18H14N2O2/c1-3-7-13(8-4-1)15-11-17(21-19-15)18-12-16(20-22-18)14-9-5-2-6-10-14/h1-11,18H,12H2
InChIKey RPUUSIJGHNDQMG-UHFFFAOYSA-N
Mol Weight 290.32 g/mol
Molecular Formula C18H14N2O2
Exact Mass 290.105528 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KsVD70C9bpY
Name 3-Phenyl-5-(3-phenyl-2-isoxazolin-5-yl)isoxazole
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 290.105527697 u
Formula C18H14N2O2
InChI InChI=1S/C18H14N2O2/c1-3-7-13(8-4-1)15-11-17(21-19-15)18-12-16(20-22-18)14-9-5-2-6-10-14/h1-11,18H,12H2
InChIKey RPUUSIJGHNDQMG-UHFFFAOYSA-N
SMILES C1(=NOC(=C1)C1ON=C(C1)C=1C=CC=CC1)C=1C=CC=CC1