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(3S)-6-bromo-8-hydroxy-7-methoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
SpectraBase Compound ID GErdwbnMtU4
InChI InChI=1S/C11H12BrNO4/c1-17-10-7(12)2-5-3-8(11(15)16)13-4-6(5)9(10)14/h2,8,13-14H,3-4H2,1H3,(H,15,16)/t8-/m0/s1
InChIKey FSANTZRXZMTOOL-QMMMGPOBSA-N
Mol Weight 302.12 g/mol
Molecular Formula C11H12BrNO4
Exact Mass 300.994971 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KDXYZEQwIml
Name (3S)-6-bromo-8-hydroxy-7-methoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H12BrNO4
InChI InChI=1S/C11H12BrNO4/c1-17-10-7(12)2-5-3-8(11(15)16)13-4-6(5)9(10)14/h2,8,13-14H,3-4H2,1H3,(H,15,16)/t8-/m0/s1
InChIKey FSANTZRXZMTOOL-QMMMGPOBSA-N
Literature Reference Author M.MA,J.ZHAO,S.WANG,S.LI,Y.YANG,J.SHI,X.FAN,L.HE
Literature Reference Citation J.NAT.PROD.,70,337(2007)
Literature Reference DOI 10.1021/np060400l
Molecular Weight 302.125 g/mol
Sample ID 30012
Solvent DMSO-D6