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2-[6-Methoxy-1-oxo-3,4-diphenylisoquinolin-2(1H)-yl] pyridine 1-oxide
SpectraBase Compound ID 3iQItKlCPDa
InChI InChI=1S/C27H20N2O3/c1-32-21-15-16-22-23(18-21)25(19-10-4-2-5-11-19)26(20-12-6-3-7-13-20)29(27(22)30)24-14-8-9-17-28(24)31/h2-18H,1H3
InChIKey BHAHNOCPKCIWTG-UHFFFAOYSA-N
Mol Weight 420.47 g/mol
Molecular Formula C27H20N2O3
Exact Mass 420.147393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1zOkF6bIzQ
Name 2-[6-Methoxy-1-oxo-3,4-diphenylisoquinolin-2(1H)-yl] pyridine 1-oxide
Appearance Colorless solid
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Formula C27H20N2O3
InChI InChI=1S/C27H20N2O3/c1-32-21-15-16-22-23(18-21)25(19-10-4-2-5-11-19)26(20-12-6-3-7-13-20)29(27(22)30)24-14-8-9-17-28(24)31/h2-18H,1H3
InChIKey BHAHNOCPKCIWTG-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/chem.201601101
Molecular Weight 420.468 g/mol
Reported Formula C27H20N2O3
SMILES C1(N2C(=C(C=3C(C2=O)=CC=C(C3)OC)C2=CC=CC=C2)C2=CC=CC=C2)=CC=CC=[N+]1[O-]
SPLASH splash10-0ue9-0404900000-49cce5087a0dd1c6228d
Source of Spectrum QE-22-SM16-5ca (DOI: 10.1002/chem.201601101)
Wiley ID 1903319