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2,6-diphenyl-4H-pyran-4-one, picrate

View entire compound with spectra: 2 NMR, 1 FTIR, 1 Raman, and 3 UV-Vis

2,6-diphenyl-4H-pyran-4-one, picrate
SpectraBase Compound ID G7GtHGmilrq
InChI InChI=1S/C17H12O2.C6H3N3O7/c18-15-11-16(13-7-3-1-4-8-13)19-17(12-15)14-9-5-2-6-10-14;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-12H;1-2,10H
InChIKey CCUXBEQXVVTDGR-UHFFFAOYSA-N
Mol Weight 477.38 g/mol
Molecular Formula C23H15N3O9
Exact Mass 477.080829 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IiJm76WGnEJ
Name 2,6-Diphenyl-4H-pyran-4-one, picrate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 477.080829066 u
Formula C23H15N3O9
InChI InChI=1S/C17H12O2.C6H3N3O7/c18-15-11-16(13-7-3-1-4-8-13)19-17(12-15)14-9-5-2-6-10-14;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-12H;1-2,10H
InChIKey CCUXBEQXVVTDGR-UHFFFAOYSA-N
Molecular Weight 477.385 g/mol
SMILES N(=O)(=O)C=1C=C(C=C(C1O)N(=O)=O)N(=O)=O.C=1C(=CC=CC1)C=1OC(=CC(C1)=O)C=1C=CC=CC1