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N'-(2-CHLOROBENZYLIDENE)-6-OXO-BENZO-[4,5]-CANTHINE-2-CARBOHYDRAZIDE
SpectraBase Compound ID HRBNPXgAupL
InChI InChI=1S/C26H15ClN4O2/c27-20-11-5-1-7-15(20)14-28-30-25(32)21-13-19-16-8-4-6-12-22(16)31-24(19)23(29-21)17-9-2-3-10-18(17)26(31)33/h1-14H,(H,30,32)/b28-14+
InChIKey YMIYKDQSWXQXKD-CCVNUDIWSA-N
Mol Weight 450.89 g/mol
Molecular Formula C26H15ClN4O2
Exact Mass 450.088353 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IqBMjziFga5
Name N'-(2-CHLOROBENZYLIDENE)-6-OXO-BENZO-[4,5]-CANTHINE-2-CARBOHYDRAZIDE
Compound Number 11C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H15ClN4O2
InChI InChI=1S/C26H15ClN4O2/c27-20-11-5-1-7-15(20)14-28-30-25(32)21-13-19-16-8-4-6-12-22(16)31-24(19)23(29-21)17-9-2-3-10-18(17)26(31)33/h1-14H,(H,30,32)/b28-14+
InChIKey YMIYKDQSWXQXKD-CCVNUDIWSA-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 450.884 g/mol
Source File Reference UWBT4634