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1-[(indol-3-yl)methyl]-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-6-ol, fumarate(1:1)(salt)
SpectraBase Compound ID 3BqTIkIUKAV
InChI InChI=1S/C20H19N3O.C4H4O4/c24-13-5-6-18-16(10-13)15-7-8-21-19(20(15)23-18)9-12-11-22-17-4-2-1-3-14(12)17;5-3(6)1-2-4(7)8/h1-6,10-11,19,21-24H,7-9H2;1-2H,(H,5,6)(H,7,8)/b;2-1+
InChIKey CCNRUEHFMGPEOK-WLHGVMLRSA-N
Mol Weight 433.46 g/mol
Molecular Formula C24H23N3O5
Exact Mass 433.163771 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9d58OqMrXfv
Name 1-[(indol-3-yl)methyl]-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-6-ol, fumarate(1:1)(salt)
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Formula C24H23N3O5
InChI InChI=1S/C20H19N3O.C4H4O4/c24-13-5-6-18-16(10-13)15-7-8-21-19(20(15)23-18)9-12-11-22-17-4-2-1-3-14(12)17;5-3(6)1-2-4(7)8/h1-6,10-11,19,21-24H,7-9H2;1-2H,(H,5,6)(H,7,8)/b;2-1+
InChIKey CCNRUEHFMGPEOK-WLHGVMLRSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 35122M
Solvent DMSO-d6