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4-Methyl-3-phenyl-2-(pyridin-2-yl) isoquinolin-1(2H)-one
SpectraBase Compound ID 8E252V84TAS
InChI InChI=1S/C21H16N2O/c1-15-17-11-5-6-12-18(17)21(24)23(19-13-7-8-14-22-19)20(15)16-9-3-2-4-10-16/h2-14H,1H3
InChIKey PUVVOSWZOYACGT-UHFFFAOYSA-N
Mol Weight 312.37 g/mol
Molecular Formula C21H16N2O
Exact Mass 312.126263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9SMsdgyBpAx
Name 4-Methyl-3-phenyl-2-(pyridin-2-yl) isoquinolin-1(2H)-one
Appearance Colorless solid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 312.126263142 u
Formula C21H16N2O
InChI InChI=1S/C21H16N2O/c1-15-17-11-5-6-12-18(17)21(24)23(19-13-7-8-14-22-19)20(15)16-9-3-2-4-10-16/h2-14H,1H3
InChIKey PUVVOSWZOYACGT-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/chem.201601101
Reported Formula C21H16N2O
SMILES C1(N2C(=C(C=3C(C2=O)=CC=CC3)C)C2=CC=CC=C2)=CC=CC=N1
SPLASH splash10-03e9-0069000000-794cfb1cd066e230f149
Source of Spectrum QE-22-SM27-5be' (DOI: 10.1002/chem.201601101)
Wiley ID 1903316