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N'-(4-DIMETHYLAMINO-BENZYLIDENE)-6-OXO-BENZO-[4,5]-CANTHINE-2-CARBOHYDRAZIDE
SpectraBase Compound ID HPzlHVkNvb4
InChI InChI=1S/C28H21N5O2/c1-32(2)18-13-11-17(12-14-18)16-29-31-27(34)23-15-22-19-7-5-6-10-24(19)33-26(22)25(30-23)20-8-3-4-9-21(20)28(33)35/h3-16H,1-2H3,(H,31,34)/b29-16+
InChIKey DBVZQDSDXBTCBQ-MUFRIFMGSA-N
Mol Weight 459.51 g/mol
Molecular Formula C28H21N5O2
Exact Mass 459.169525 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K4NWN56WJ2s
Name N'-(4-DIMETHYLAMINO-BENZYLIDENE)-6-OXO-BENZO-[4,5]-CANTHINE-2-CARBOHYDRAZIDE
Compound Number 11E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H21N5O2
InChI InChI=1S/C28H21N5O2/c1-32(2)18-13-11-17(12-14-18)16-29-31-27(34)23-15-22-19-7-5-6-10-24(19)33-26(22)25(30-23)20-8-3-4-9-21(20)28(33)35/h3-16H,1-2H3,(H,31,34)/b29-16+
InChIKey DBVZQDSDXBTCBQ-MUFRIFMGSA-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 459.507 g/mol
Source File Reference UWBT4636