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6-(6',7'-DIHYDROXY-2'-METHYL-1',2',3',4'-TETRAHYDROISOQUINOLIN-1'-YL)-FURO-[3,4-E]-1,3-BENZODIOXOL-8(6H)-ONE;HYDROBROMIDE

View entire compound with spectra: 1 NMR

6-(6',7'-DIHYDROXY-2'-METHYL-1',2',3',4'-TETRAHYDROISOQUINOLIN-1'-YL)-FURO-[3,4-E]-1,3-BENZODIOXOL-8(6H)-ONE;HYDROBROMIDE
SpectraBase Compound ID JLdMhxglKLp
InChI InChI=1S/C19H17NO6.BrH/c1-20-5-4-9-6-12(21)13(22)7-11(9)16(20)17-10-2-3-14-18(25-8-24-14)15(10)19(23)26-17;/h2-3,6-7,16-17,21-22H,4-5,8H2,1H3;1H/t16-,17-;/m1./s1
InChIKey QDLTZBBIROZZQT-GBNZRNLASA-N
Mol Weight 436.26 g/mol
Molecular Formula C19H18BrNO6
Exact Mass 435.03175 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FRmaVkzhEzB
Name 6-(6',7'-DIHYDROXY-2'-METHYL-1',2',3',4'-TETRAHYDROISOQUINOLIN-1'-YL)-FURO-[3,4-E]-1,3-BENZODIOXOL-8(6H)-ONE;HYDROBROMIDE
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H18BrNO6
InChI InChI=1S/C19H17NO6.BrH/c1-20-5-4-9-6-12(21)13(22)7-11(9)16(20)17-10-2-3-14-18(25-8-24-14)15(10)19(23)26-17;/h2-3,6-7,16-17,21-22H,4-5,8H2,1H3;1H/t16-,17-;/m1./s1
InChIKey QDLTZBBIROZZQT-GBNZRNLASA-N
Literature Reference Author R.D.ALLAN,C.APOSTOPOULOS
Literature Reference Citation AUSTR.J.CHEM.,43,1259(1990)
Literature Reference DOI 10.1071/ch9901259
Molecular Weight 436.259 g/mol
Solvent D2O:DIOXANE
Source File Reference UWED10085