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[3-[2-(2-AMINOPHENYL)-1-(PHENETHYLTHIO)-ETHYL]-1H-INDOLE]-5-CARBOXYLIC-ACID
SpectraBase Compound ID DgqQ2GgRskB
InChI InChI=1S/C25H24N2O2S/c26-22-9-5-4-8-18(22)15-24(30-13-12-17-6-2-1-3-7-17)21-16-27-23-11-10-19(25(28)29)14-20(21)23/h1-11,14,16,24,27H,12-13,15,26H2,(H,28,29)
InChIKey MHHKSYZDQWTTJT-UHFFFAOYSA-N
Mol Weight 416.54 g/mol
Molecular Formula C25H24N2O2S
Exact Mass 416.155849 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FeP4p8q6kps
Name [3-[2-(2-AMINOPHENYL)-1-(PHENETHYLTHIO)-ETHYL]-1H-INDOLE]-5-CARBOXYLIC-ACID
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H24N2O2S
InChI InChI=1S/C25H24N2O2S/c26-22-9-5-4-8-18(22)15-24(30-13-12-17-6-2-1-3-7-17)21-16-27-23-11-10-19(25(28)29)14-20(21)23/h1-11,14,16,24,27H,12-13,15,26H2,(H,28,29)
InChIKey MHHKSYZDQWTTJT-UHFFFAOYSA-N
Literature Reference Author F.MITULIS,A.GOGOLL,I.MUTULE,S.YAHORAVA,A.YAHORAU,E.LIEPINSH, J.E.S.WIKBERG
Literature Reference Citation MOLECULES,13,1846(2008)
Literature Reference DOI 10.3390/molecules13081846
Molecular Weight 416.538 g/mol
Sample ID 56882
Solvent DMSO-D6