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6-Nitro-3,4-diphenylisoquinolin-1(2H)-one
SpectraBase Compound ID 5fZyqTDt597
InChI InChI=1S/C21H14N2O3/c24-21-17-12-11-16(23(25)26)13-18(17)19(14-7-3-1-4-8-14)20(22-21)15-9-5-2-6-10-15/h1-13H,(H,22,24)
InChIKey ALROFZQOVBRTQR-UHFFFAOYSA-N
Mol Weight 342.35 g/mol
Molecular Formula C21H14N2O3
Exact Mass 342.100442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8ZblX6rHH8m
Name 6-Nitro-3,4-diphenylisoquinolin-1(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H14N2O3
InChI InChI=1S/C21H14N2O3/c24-21-17-12-11-16(23(25)26)13-18(17)19(14-7-3-1-4-8-14)20(22-21)15-9-5-2-6-10-15/h1-13H,(H,22,24)
InChIKey ALROFZQOVBRTQR-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo501884v
Molecular Weight 342.354 g/mol
SMILES N1C(c2ccc(cc2C(=C1c1ccccc1)c1ccccc1)[N+](=O)[O-])=O
SPLASH splash10-0006-0219000000-2ad4b9c9c410a920f4cd
Source of Spectrum J-79-12077-3ha
Synonyms 6-Nitro-3,4-diphenyl-2H-isoquinolin-1-one
Wiley ID 1755632