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Ethyl (7S,9S)-9-(1H-indol-3-yl)-6,7,8,9-tetrahydro-[1,3]dioxolo[4,5-f]quinoline-7-carboxylate
SpectraBase Compound ID 5FlJfm71FJp
InChI InChI=1S/C21H20N2O4/c1-2-25-21(24)17-9-13(14-10-22-15-6-4-3-5-12(14)15)19-16(23-17)7-8-18-20(19)27-11-26-18/h3-8,10,13,17,22-23H,2,9,11H2,1H3/t13-,17-/m0/s1
InChIKey AMYCNUXMXPYLEA-GUYCJALGSA-N
Mol Weight 364.4 g/mol
Molecular Formula C21H20N2O4
Exact Mass 364.142307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID xYKCxQuhJ
Name Ethyl (7S,9S)-9-(1H-indol-3-yl)-6,7,8,9-tetrahydro-[1,3]dioxolo[4,5-f]quinoline-7-carboxylate
Appearance Brown oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 364.142307128 u
Formula C21H20N2O4
InChI InChI=1S/C21H20N2O4/c1-2-25-21(24)17-9-13(14-10-22-15-6-4-3-5-12(14)15)19-16(23-17)7-8-18-20(19)27-11-26-18/h3-8,10,13,17,22-23H,2,9,11H2,1H3/t13-,17-/m0/s1
InChIKey AMYCNUXMXPYLEA-GUYCJALGSA-N
Instrument Name Finnigan-MAT-95
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201701502
Molecular Weight 364.401 g/mol
Quality 56
Reported Formula C21H20O4N2
SMILES N1C2=CC=C3C(=C2[C@](C2=CNC4=C2C=CC=C4)(C[C@]1(C(=O)OCC)[H])[H])OCO3
SPLASH splash10-01ox-0297000000-35bb33b0815aaaf74905
Source of Spectrum K1-2018-SM21-16af (DOI: 10.1002/ejoc.201701502)
Thin-Layer Chromatography 0.36 (cyclohexane/EtOAc, 2:1)
Wiley ID 1891526