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N-ISOPROPYL-6-OXO-BENZO-[4,5]-CANTHINE-2-CARBXAMIDE
SpectraBase Compound ID 8OGMfmq8lkJ
InChI InChI=1S/C22H17N3O2/c1-12(2)23-21(26)17-11-16-13-7-5-6-10-18(13)25-20(16)19(24-17)14-8-3-4-9-15(14)22(25)27/h3-12H,1-2H3,(H,23,26)
InChIKey SZZPXBUSOLIYMV-UHFFFAOYSA-N
Mol Weight 355.4 g/mol
Molecular Formula C22H17N3O2
Exact Mass 355.132077 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C5DFM0OwU80
Name N-ISOPROPYL-6-OXO-BENZO-[4,5]-CANTHINE-2-CARBXAMIDE
Compound Number 13A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H17N3O2
InChI InChI=1S/C22H17N3O2/c1-12(2)23-21(26)17-11-16-13-7-5-6-10-18(13)25-20(16)19(24-17)14-8-3-4-9-15(14)22(25)27/h3-12H,1-2H3,(H,23,26)
InChIKey SZZPXBUSOLIYMV-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 355.396 g/mol
Source File Reference UWBT4637