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Oxobuxifoline

View entire compound with spectra: 2 NMR, and 1 MS (GC)

Oxobuxifoline
SpectraBase Compound ID 8lcD04D5f0e
InChI InChI=1S/C19H13NO5/c1-22-9-3-4-10-12(7-9)16(21)15-13-11(5-6-20-15)17(23-2)19-18(14(10)13)24-8-25-19/h3-7H,8H2,1-2H3
InChIKey COZVCMSRTUAQHU-UHFFFAOYSA-N
Mol Weight 335.32 g/mol
Molecular Formula C19H13NO5
Exact Mass 335.079373 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2A8vNtNy8Pc
Name OXOBUXIFOLINE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H13NO5
InChI InChI=1S/C19H13NO5/c1-22-9-3-4-10-12(7-9)16(21)15-13-11(5-6-20-15)17(23-2)19-18(14(10)13)24-8-25-19/h3-7H,8H2,1-2H3
InChIKey COZVCMSRTUAQHU-UHFFFAOYSA-N
Literature Reference Author J.M.DESIQUEIRA,M.G.ZIMINIANI,U.M.RESENDE,M.A.D.BOAVENTURA
Literature Reference Citation QUIM.NOVA,24,185(2001)
Literature Reference DOI 10.1590/s0100-40422001000200006
Molecular Weight 335.316 g/mol
Solvent DMSO-D6
Source File Reference UWBT12308