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Methyl (-)-3S-8-bromo-6-hydroxy-7-methoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylate
SpectraBase Compound ID F704E23RD8w
InChI InChI=1S/C12H14BrNO4/c1-17-11-9(15)4-6-3-8(12(16)18-2)14-5-7(6)10(11)13/h4,8,14-15H,3,5H2,1-2H3/t8-/m0/s1
InChIKey OAYVVDQWZFAYNG-QMMMGPOBSA-N
Mol Weight 316.15 g/mol
Molecular Formula C12H14BrNO4
Exact Mass 315.010621 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2EblBpfmJMP
Name Methyl (3S)-8-bromo-6-hydroxy-7-methoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylate
Alternate Name(s) Methyl (3S)-8-bromanyl-7-methoxy-6-oxidanyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylate
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Formula C12H14BrNO4
InChI InChI=1S/C12H14BrNO4/c1-17-11-9(15)4-6-3-8(12(16)18-2)14-5-7(6)10(11)13/h4,8,14-15H,3,5H2,1-2H3/t8-/m0/s1
InChIKey OAYVVDQWZFAYNG-QMMMGPOBSA-N
Molecular Weight 316.151 g/mol
SMILES N1[C@@](Cc2cc(c(c(c2C1)Br)OC)O)(C(=O)OC)[H]
SPLASH splash10-0a4i-0191000000-5c375d891236e894515d
Source of Spectrum G4-70-341-6
Wiley ID 1694676