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N'-(4-METHOXYBENZYLIDENE)-6-OXO-BENZO-[4,5]-CANTHINE-2-CARBOHYDRAZIDE
SpectraBase Compound ID LnZ6MXGSj7N
InChI InChI=1S/C27H18N4O3/c1-34-17-12-10-16(11-13-17)15-28-30-26(32)22-14-21-18-6-4-5-9-23(18)31-25(21)24(29-22)19-7-2-3-8-20(19)27(31)33/h2-15H,1H3,(H,30,32)/b28-15+
InChIKey KKCVKXDUBITFDE-RWPZCVJISA-N
Mol Weight 446.47 g/mol
Molecular Formula C27H18N4O3
Exact Mass 446.13789 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1FVhqERO5wN
Name N'-(4-METHOXYBENZYLIDENE)-6-OXO-BENZO-[4,5]-CANTHINE-2-CARBOHYDRAZIDE
Compound Number 11B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H18N4O3
InChI InChI=1S/C27H18N4O3/c1-34-17-12-10-16(11-13-17)15-28-30-26(32)22-14-21-18-6-4-5-9-23(18)31-25(21)24(29-22)19-7-2-3-8-20(19)27(31)33/h2-15H,1H3,(H,30,32)/b28-15+
InChIKey KKCVKXDUBITFDE-RWPZCVJISA-N
Literature Reference Author C.M.B.L.SILVA,F.P.GARCIA,J.H.D.S.RODRIGUES,C.V.NAKAMURA,T.UE DA-NAKAMURA,E.MEYER
Literature Reference Citation CHEM.PHARM.BULL.,60,1372(2012)
Literature Reference DOI 10.1248/cpb.c12-00356
Molecular Weight 446.465 g/mol
Source File Reference UWBT4633