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1H-indole, 2-methyl-1-[2-oxo-2-(1-pyrrolidinyl)ethyl]-3-[1,2,3,6-tetrahydro-1-[(phenylmethyl)sulfonyl]-4-pyridinyl]-
SpectraBase Compound ID DKTPhqkCysK
InChI InChI=1S/C27H31N3O3S/c1-21-27(23-13-17-29(18-14-23)34(32,33)20-22-9-3-2-4-10-22)24-11-5-6-12-25(24)30(21)19-26(31)28-15-7-8-16-28/h2-6,9-13H,7-8,14-20H2,1H3
InChIKey HORGEVDYNLHIIR-UHFFFAOYSA-N
Mol Weight 477.62 g/mol
Molecular Formula C27H31N3O3S
Exact Mass 477.208613 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Gi8FYcxuiOi
Name 1H-indole, 2-methyl-1-[2-oxo-2-(1-pyrrolidinyl)ethyl]-3-[1,2,3,6-tetrahydro-1-[(phenylmethyl)sulfonyl]-4-pyridinyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 477.208613041 u
Formula C27H31N3O3S
InChI InChI=1S/C27H31N3O3S/c1-21-27(23-13-17-29(18-14-23)34(32,33)20-22-9-3-2-4-10-22)24-11-5-6-12-25(24)30(21)19-26(31)28-15-7-8-16-28/h2-6,9-13H,7-8,14-20H2,1H3
InChIKey HORGEVDYNLHIIR-UHFFFAOYSA-N
Molecular Weight 477.623 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_4908
Solvent DMSO-d6
Source Vendor ID: NMR/12708524