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4,7-BIS-(4-HYDROXY-BUTYLAMINO)-3-[1-(2-HYDROXY-PHENYLIMINO)-ETHYL]-CHROMEN-2-ONE
SpectraBase Compound ID 4Xah8N2YBux
InChI InChI=1S/C25H31N3O5/c1-17(28-20-8-2-3-9-21(20)31)23-24(27-13-5-7-15-30)19-11-10-18(26-12-4-6-14-29)16-22(19)33-25(23)32/h2-3,8-11,16,26-27,29-31H,4-7,12-15H2,1H3/b28-17+
InChIKey HFIDNBXDVPIGRX-OGLMXYFKSA-N
Mol Weight 453.54 g/mol
Molecular Formula C25H31N3O5
Exact Mass 453.226371 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5Sg5EhmieTo
Name 4,7-BIS-(4-HYDROXY-BUTYLAMINO)-3-[1-(2-HYDROXY-PHENYLIMINO)-ETHYL]-CHROMEN-2-ONE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H31N3O5
InChI InChI=1S/C25H31N3O5/c1-17(28-20-8-2-3-9-21(20)31)23-24(27-13-5-7-15-30)19-11-10-18(26-12-4-6-14-29)16-22(19)33-25(23)32/h2-3,8-11,16,26-27,29-31H,4-7,12-15H2,1H3/b28-17+
InChIKey HFIDNBXDVPIGRX-OGLMXYFKSA-N
Literature Reference Author A.BEHRAMI,S.DEMAKU,B.DOBRA,I.SHEHU
Literature Reference Citation INT.J.PH.SC.R.R.,20,4(2013)
Molecular Weight 453.538 g/mol
Solvent DMSO-D6
Source File Reference UWBT13466