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1H-indole, 2-methyl-3-[1-[(4-nitrophenyl)sulfonyl]-4-piperidinyl]-
SpectraBase Compound ID D1IM0TODHkt
InChI InChI=1S/C20H21N3O4S/c1-14-20(18-4-2-3-5-19(18)21-14)15-10-12-22(13-11-15)28(26,27)17-8-6-16(7-9-17)23(24)25/h2-9,15,21H,10-13H2,1H3
InChIKey BOQRWKAEGRVVLZ-UHFFFAOYSA-N
Mol Weight 399.47 g/mol
Molecular Formula C20H21N3O4S
Exact Mass 399.125277 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JI1ih96po5Z
Name 1H-indole, 2-methyl-3-[1-[(4-nitrophenyl)sulfonyl]-4-piperidinyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 399.125277338 u
Formula C20H21N3O4S
InChI InChI=1S/C20H21N3O4S/c1-14-20(18-4-2-3-5-19(18)21-14)15-10-12-22(13-11-15)28(26,27)17-8-6-16(7-9-17)23(24)25/h2-9,15,21H,10-13H2,1H3
InChIKey BOQRWKAEGRVVLZ-UHFFFAOYSA-N
Molecular Weight 399.465 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_4877
Solvent DMSO-d6
Source Vendor ID: NMR/12708467