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3-HYDROXY-AMIODARONE
SpectraBase Compound ID LG4Pfq253sn
InChI InChI=1S/C25H29I2NO4/c1-4-28(5-2)12-13-31-25-19(26)14-17(15-20(25)27)24(30)23-18-8-6-7-9-21(18)32-22(23)11-10-16(3)29/h6-9,14-16,29H,4-5,10-13H2,1-3H3
InChIKey IIOUFGJTYMDOPR-UHFFFAOYSA-N
Mol Weight 661.32 g/mol
Molecular Formula C25H29I2NO4
Exact Mass 661.018598 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9onRIQ7jShG
Name 3-HYDROXY-AMIODARONE
Compound Number M2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H29I2NO4
InChI InChI=1S/C25H29I2NO4/c1-4-28(5-2)12-13-31-25-19(26)14-17(15-20(25)27)24(30)23-18-8-6-7-9-21(18)32-22(23)11-10-16(3)29/h6-9,14-16,29H,4-5,10-13H2,1-3H3
InChIKey IIOUFGJTYMDOPR-UHFFFAOYSA-N
Literature Reference Author C.A.LEE,J.P.JONES,J.KATAYAMA,R.KASPERA,Y.JIANG,S.FREIWALD,E. SMITH,G.S.WALKER,R.A
Literature Reference Citation DRUG.MET.DISP.,40,943(2012)
Literature Reference DOI 10.1124/dmd.111.043505
Molecular Weight 661.319 g/mol
Source File Reference UWLU75288