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N'-(4-FLUOROBENZYLIDENE)-6-OXO-BENZO-[4,5]-CANTHINE-2-CARBOHYDRAZIDE
SpectraBase Compound ID IypC8i7bX7G
InChI InChI=1S/C26H15FN4O2/c27-16-11-9-15(10-12-16)14-28-30-25(32)21-13-20-17-5-3-4-8-22(17)31-24(20)23(29-21)18-6-1-2-7-19(18)26(31)33/h1-14H,(H,30,32)/b28-14+
InChIKey DSLHQXNKSYYAFC-CCVNUDIWSA-N
Mol Weight 434.43 g/mol
Molecular Formula C26H15FN4O2
Exact Mass 434.117904 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9CO2zeHvK4N
Name N'-(4-FLUOROBENZYLIDENE)-6-OXO-BENZO-[4,5]-CANTHINE-2-CARBOHYDRAZIDE
Compound Number 11D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H15FN4O2
InChI InChI=1S/C26H15FN4O2/c27-16-11-9-15(10-12-16)14-28-30-25(32)21-13-20-17-5-3-4-8-22(17)31-24(20)23(29-21)18-6-1-2-7-19(18)26(31)33/h1-14H,(H,30,32)/b28-14+
InChIKey DSLHQXNKSYYAFC-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 434.429 g/mol
Solvent DMSO-D6
Source File Reference UWBT4635