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2-(Amino)-N-(9,10-dioxoanthacene-1-yl)-propaneamido
SpectraBase Compound ID 2qjddvmNzxU
InChI InChI=1S/C17H14N2O3/c1-9(18)17(22)19-13-8-4-7-12-14(13)16(21)11-6-3-2-5-10(11)15(12)20/h2-9H,18H2,1H3,(H,19,22)
InChIKey ITMWPNKZQMYLIQ-UHFFFAOYSA-N
Mol Weight 294.31 g/mol
Molecular Formula C17H14N2O3
Exact Mass 294.100442 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C3oxc5MXgqu
Name 2-(Amino)-N-(9,10-dioxoanthacene-1-yl)-propaneamido
Comments Computed using HOSE algorithm
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Exact Mass 294.100442316 u
Formula C17H14N2O3
InChI InChI=1S/C17H14N2O3/c1-9(18)17(22)19-13-8-4-7-12-14(13)16(21)11-6-3-2-5-10(11)15(12)20/h2-9H,18H2,1H3,(H,19,22)
InChIKey ITMWPNKZQMYLIQ-UHFFFAOYSA-N
SMILES C1=CC=C2C(=C1)C(C=1C(C2=O)=C(C=CC1)NC(=O)C(N)C)=O