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2-(Diethylamino)-N-(9,10-dioxoanthracene-2-yl)-ethanamide
SpectraBase Compound ID Hl6tZid4uiV
InChI InChI=1S/C20H20N2O3/c1-3-22(4-2)12-18(23)21-13-9-10-16-17(11-13)20(25)15-8-6-5-7-14(15)19(16)24/h5-11H,3-4,12H2,1-2H3,(H,21,23)
InChIKey BWNPHRBQMLZCDQ-UHFFFAOYSA-N
Mol Weight 336.39 g/mol
Molecular Formula C20H20N2O3
Exact Mass 336.147393 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7im9xX2G4Z2
Name 2-(Diethylamino)-N-(9,10-dioxoanthracene-2-yl)-ethanamide
Comments Computed using HOSE algorithm
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Exact Mass 336.147392509 u
Formula C20H20N2O3
InChI InChI=1S/C20H20N2O3/c1-3-22(4-2)12-18(23)21-13-9-10-16-17(11-13)20(25)15-8-6-5-7-14(15)19(16)24/h5-11H,3-4,12H2,1-2H3,(H,21,23)
InChIKey BWNPHRBQMLZCDQ-UHFFFAOYSA-N
Molecular Weight 336.391 g/mol
SMILES C1=CC=C2C(=C1)C(C=1C(C2=O)=CC(=CC1)NC(=O)CN(CC)CC)=O