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1-piperidinecarboxylic acid, 4-[[3-[(1-acetyl-5-bromo-2,3-dihydro-1H-indol-7-yl)sulfonyl]-1-oxopropyl]amino]-, ethyl ester
SpectraBase Compound ID 2PyGCSjBev4
InChI InChI=1S/C21H28BrN3O6S/c1-3-31-21(28)24-8-5-17(6-9-24)23-19(27)7-11-32(29,30)18-13-16(22)12-15-4-10-25(14(2)26)20(15)18/h12-13,17H,3-11H2,1-2H3,(H,23,27)
InChIKey ZLRXMHKLPPVHCF-UHFFFAOYSA-N
Mol Weight 530.43 g/mol
Molecular Formula C21H28BrN3O6S
Exact Mass 529.08822 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3dQlZFcm8VL
Name 1-piperidinecarboxylic acid, 4-[[3-[(1-acetyl-5-bromo-2,3-dihydro-1H-indol-7-yl)sulfonyl]-1-oxopropyl]amino]-, ethyl ester
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H28BrN3O6S/c1-3-31-21(28)24-8-5-17(6-9-24)23-19(27)7-11-32(29,30)18-13-16(22)12-15-4-10-25(14(2)26)20(15)18/h12-13,17H,3-11H2,1-2H3,(H,23,27)
InChIKey ZLRXMHKLPPVHCF-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_7828
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/12239905