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1H-indole-1-ethanol, 2-methyl-alpha-[[(4-methylphenyl)amino]methyl]-3-[1,2,3,6-tetrahydro-1-[(4-methylphenyl)sulfonyl]-4-

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1H-indole-1-ethanol, 2-methyl-alpha-[[(4-methylphenyl)amino]methyl]-3-[1,2,3,6-tetrahydro-1-[(4-methylphenyl)sulfonyl]-4-
SpectraBase Compound ID J6I3bAlq8Kd
InChI InChI=1S/C31H35N3O3S/c1-22-8-12-26(13-9-22)32-20-27(35)21-34-24(3)31(29-6-4-5-7-30(29)34)25-16-18-33(19-17-25)38(36,37)28-14-10-23(2)11-15-28/h4-16,27,32,35H,17-21H2,1-3H3
InChIKey ZRFKNRKAJCHUAI-UHFFFAOYSA-N
Mol Weight 529.7 g/mol
Molecular Formula C31H35N3O3S
Exact Mass 529.239913 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID H3khSu63fju
Name 1H-indole-1-ethanol, 2-methyl-alpha-[[(4-methylphenyl)amino]methyl]-3-[1,2,3,6-tetrahydro-1-[(4-methylphenyl)sulfonyl]-4-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 529.239913170 u
Formula C31H35N3O3S
InChI InChI=1S/C31H35N3O3S/c1-22-8-12-26(13-9-22)32-20-27(35)21-34-24(3)31(29-6-4-5-7-30(29)34)25-16-18-33(19-17-25)38(36,37)28-14-10-23(2)11-15-28/h4-16,27,32,35H,17-21H2,1-3H3
InChIKey ZRFKNRKAJCHUAI-UHFFFAOYSA-N
Molecular Weight 529.699 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_6605
Solvent DMSO-d6
Source Vendor ID: NMR/12709710