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2-[6-Methyl-1-oxo-3, 4-diphenylisoquinolin-2(1H)-yl] pyridine 1-oxide
SpectraBase Compound ID 4OVYi04Gkvy
InChI InChI=1S/C27H20N2O2/c1-19-15-16-22-23(18-19)25(20-10-4-2-5-11-20)26(21-12-6-3-7-13-21)29(27(22)30)24-14-8-9-17-28(24)31/h2-18H,1H3
InChIKey JJVGVEWROZWZQY-UHFFFAOYSA-N
Mol Weight 404.47 g/mol
Molecular Formula C27H20N2O2
Exact Mass 404.152478 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5EwkQ4634AN
Name 2-[6-Methyl-1-oxo-3, 4-diphenylisoquinolin-2(1H)-yl] pyridine 1-oxide
Appearance Colorless solid
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Formula C27H20N2O2
InChI InChI=1S/C27H20N2O2/c1-19-15-16-22-23(18-19)25(20-10-4-2-5-11-20)26(21-12-6-3-7-13-21)29(27(22)30)24-14-8-9-17-28(24)31/h2-18H,1H3
InChIKey JJVGVEWROZWZQY-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/chem.201601101
Molecular Weight 404.469 g/mol
Reported Formula C27H20N2O2
SMILES C1(N2C(=C(C=3C(C2=O)=CC=C(C3)C)C2=CC=CC=C2)C2=CC=CC=C2)=CC=CC=[N+]1[O-]
SPLASH splash10-001i-0971100000-260c89f651392840d26e
Source of Spectrum QE-22-SM13-5aa (DOI: 10.1002/chem.201601101)
Wiley ID 1903308