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Quinoxaline, 2,3-diphenyl-6-[(4-phenyl-1-piperazinyl)carbonyl]-
SpectraBase Compound ID 5p13tlw55fQ
InChI InChI=1S/C31H26N4O/c36-31(35-20-18-34(19-21-35)26-14-8-3-9-15-26)25-16-17-27-28(22-25)33-30(24-12-6-2-7-13-24)29(32-27)23-10-4-1-5-11-23/h1-17,22H,18-21H2
InChIKey NFEGJHURJAMTSA-UHFFFAOYSA-N
Mol Weight 470.58 g/mol
Molecular Formula C31H26N4O
Exact Mass 470.210661 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I9n3T1NnpGk
Name Quinoxaline, 2,3-diphenyl-6-[(4-phenyl-1-piperazinyl)carbonyl]-
Comments Computed using HOSE algorithm
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Exact Mass 470.210661472 u
Formula C31H26N4O
InChI InChI=1S/C31H26N4O/c36-31(35-20-18-34(19-21-35)26-14-8-3-9-15-26)25-16-17-27-28(22-25)33-30(24-12-6-2-7-13-24)29(32-27)23-10-4-1-5-11-23/h1-17,22H,18-21H2
InChIKey NFEGJHURJAMTSA-UHFFFAOYSA-N
Molecular Weight 470.576 g/mol
SMILES C=1C=CC(N2CCN(C(C=3C=C4N=C(C(C5=CC=CC=C5)=NC4=CC3)C=3C=CC=CC3)=O)CC2)=CC1