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1-[4'-(N,N'-Dimethylamino)phenyl]-1,4-dihydro-3(2H)-isoquinolinone-
SpectraBase Compound ID 5J7dcvmysdZ
InChI InChI=1S/C17H18N2O/c1-19(2)14-9-7-12(8-10-14)17-15-6-4-3-5-13(15)11-16(20)18-17/h3-10,17H,11H2,1-2H3,(H,18,20)
InChIKey IMAFYGXPHLEZGM-UHFFFAOYSA-N
Mol Weight 266.34 g/mol
Molecular Formula C17H18N2O
Exact Mass 266.141913 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2OZjeeudj2j
Name 1-[4'-(N,N'-Dimethylamino)phenyl]-1,4-dihydro-3(2H)-isoquinolinone-
Comments Computed using HOSE algorithm
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Exact Mass 266.141913207 u
Formula C17H18N2O
InChI InChI=1S/C17H18N2O/c1-19(2)14-9-7-12(8-10-14)17-15-6-4-3-5-13(15)11-16(20)18-17/h3-10,17H,11H2,1-2H3,(H,18,20)
InChIKey IMAFYGXPHLEZGM-UHFFFAOYSA-N
Molecular Weight 266.344 g/mol
SMILES C1(NC(CC=2C=CC=CC12)=O)C1=CC=C(C=C1)N(C)C