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cis-(1R,3R)-Methyl 1-(4-hydroxy-3-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
SpectraBase Compound ID Kb5yoJ5GTcN
InChI InChI=1S/C20H20N2O4/c1-25-17-9-11(7-8-16(17)23)18-19-13(10-15(22-18)20(24)26-2)12-5-3-4-6-14(12)21-19/h3-9,15,18,21-23H,10H2,1-2H3/t15-,18-/m1/s1
InChIKey BGCTZYDFAWJFDE-CRAIPNDOSA-N
Mol Weight 352.39 g/mol
Molecular Formula C20H20N2O4
Exact Mass 352.142307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BuoiCda0kw1
Name cis-(1R,3R)-Methyl 1-(4-hydroxy-3-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
Alternate Name(s) (1R,3R)-1-(4-hydroxy-3-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid methyl ester Methyl (1R,3R)-1-(4-hydroxy-3-methoxyphenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate Methyl (1R,3R)-1-(4-hydroxy-3-methoxy-phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate Methyl (1R,3R)-1-(3-methoxy-4-oxidanyl-phenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
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Formula C20H20N2O4
InChI InChI=1S/C20H20N2O4/c1-25-17-9-11(7-8-16(17)23)18-19-13(10-15(22-18)20(24)26-2)12-5-3-4-6-14(12)21-19/h3-9,15,18,21-23H,10H2,1-2H3/t15-,18-/m1/s1
InChIKey BGCTZYDFAWJFDE-CRAIPNDOSA-N
Molecular Weight 352.390 g/mol
SMILES [nH]1c2ccccc2c2c1[C@@](c1ccc(c(c1)OC)O)(N[C@](C2)(C(=O)OC)[H])[H]
SPLASH splash10-0udi-0159000000-5826c3eda376d1b2db1a
Source of Spectrum QC-20-435-2e
Wiley ID 1688028