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2-(1-PHENYL-9H-BETA-CARBOLIN-3-YL)-4-(3-NITROBENZYLIDENE)-4H-OXAZOL-5-ONE
SpectraBase Compound ID RCCkqs9Dqn
InChI InChI=1S/C27H16N4O4/c32-27-23(14-16-7-6-10-18(13-16)31(33)34)30-26(35-27)22-15-20-19-11-4-5-12-21(19)28-25(20)24(29-22)17-8-2-1-3-9-17/h1-15,28H/b23-14-
InChIKey SLZJJUFNICVYHA-UCQKPKSFSA-N
Mol Weight 460.45 g/mol
Molecular Formula C27H16N4O4
Exact Mass 460.117155 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5B0OWO21EfF
Name 2-(1-PHENYL-9H-BETA-CARBOLIN-3-YL)-4-(3-NITROBENZYLIDENE)-4H-OXAZOL-5-ONE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H16N4O4
InChI InChI=1S/C27H16N4O4/c32-27-23(14-16-7-6-10-18(13-16)31(33)34)30-26(35-27)22-15-20-19-11-4-5-12-21(19)28-25(20)24(29-22)17-8-2-1-3-9-17/h1-15,28H/b23-14-
InChIKey SLZJJUFNICVYHA-UCQKPKSFSA-N
Literature Reference Author F.C.SAVARIZ,M.A.FOGLIO,J.E.D.CARVALHO,A.L.T.G.RUIZ,M.C.T.DUA RTE,M.F.D.ROSA,E.MEY
Literature Reference Citation MOLECULES,17,6100(2012)
Literature Reference DOI 10.3390/molecules17056100
Molecular Weight 460.448 g/mol
Sample ID 847
Solvent DMSO-D6