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N-[2-(3,4,6,7-Tetramethoxy-1-phenanthryl)ethyl]acetamide
SpectraBase Compound ID VE6teRNxXl
InChI InChI=1S/C22H25NO5/c1-13(24)23-9-8-15-11-20(27-4)22(28-5)21-16(15)7-6-14-10-18(25-2)19(26-3)12-17(14)21/h6-7,10-12H,8-9H2,1-5H3,(H,23,24)
InChIKey YQEJKORVFWCTGE-UHFFFAOYSA-N
Mol Weight 383.44 g/mol
Molecular Formula C22H25NO5
Exact Mass 383.173273 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CUqRN4C1H9z
Name N-[2-(3,4,6,7-Tetramethoxy-1-phenanthryl)ethyl]acetamide
Comments Computed using HOSE algorithm
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Exact Mass 383.173272904 u
Formula C22H25NO5
InChI InChI=1S/C22H25NO5/c1-13(24)23-9-8-15-11-20(27-4)22(28-5)21-16(15)7-6-14-10-18(25-2)19(26-3)12-17(14)21/h6-7,10-12H,8-9H2,1-5H3,(H,23,24)
InChIKey YQEJKORVFWCTGE-UHFFFAOYSA-N
Molecular Weight 383.444 g/mol
SMILES C(C)(=O)NCCC=1C=C(C(=C2C3=CC(=C(C=C3C=CC12)OC)OC)OC)OC