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acetamide, N-[2-(1,3-dioxo-1H-benz[de]isoquinolin-2(3H)-yl)ethyl]-
SpectraBase Compound ID a2pnZXg18b
InChI InChI=1S/C16H14N2O3/c1-10(19)17-8-9-18-15(20)12-6-2-4-11-5-3-7-13(14(11)12)16(18)21/h2-7H,8-9H2,1H3,(H,17,19)
InChIKey LLVDLDUBDOZCKX-UHFFFAOYSA-N
Mol Weight 282.3 g/mol
Molecular Formula C16H14N2O3
Exact Mass 282.100442 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ClxFfD1pyLS
Name Acetamide, N-[2-(1,3-dioxo-1H-benz[de]isoquinolin-2(3H)-yl)ethyl]-
Comments Computed using HOSE algorithm
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Exact Mass 282.100442316 u
Formula C16H14N2O3
InChI InChI=1S/C16H14N2O3/c1-10(19)17-8-9-18-15(20)12-6-2-4-11-5-3-7-13(14(11)12)16(18)21/h2-7H,8-9H2,1H3,(H,17,19)
InChIKey LLVDLDUBDOZCKX-UHFFFAOYSA-N
Molecular Weight 282.299 g/mol
SMILES N(C(=O)C)CCN1C(C2=CC=CC3=C2C(C1=O)=CC=C3)=O