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N-BUTYL-6-OXO-BENZO-[4,5]-CANTHINE-2-CARBOXAMIDE
SpectraBase Compound ID Bocyn8k7cp7
InChI InChI=1S/C23H19N3O2/c1-2-3-12-24-22(27)18-13-17-14-8-6-7-11-19(14)26-21(17)20(25-18)15-9-4-5-10-16(15)23(26)28/h4-11,13H,2-3,12H2,1H3,(H,24,27)
InChIKey KILCYEKBEBZGCG-UHFFFAOYSA-N
Mol Weight 369.42 g/mol
Molecular Formula C23H19N3O2
Exact Mass 369.147727 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GM5xL9t004Z
Name N-BUTYL-6-OXO-BENZO-[4,5]-CANTHINE-2-CARBOXAMIDE
Compound Number 13B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H19N3O2
InChI InChI=1S/C23H19N3O2/c1-2-3-12-24-22(27)18-13-17-14-8-6-7-11-19(14)26-21(17)20(25-18)15-9-4-5-10-16(15)23(26)28/h4-11,13H,2-3,12H2,1H3,(H,24,27)
InChIKey KILCYEKBEBZGCG-UHFFFAOYSA-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 369.423 g/mol
Source File Reference UWBT4638