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1H-indole, 5-bromo-7-[[3-(hexahydro-1H-azepin-1-yl)-3-oxopropyl]sulfonyl]-2,3-dihydro-1-(1-oxopropyl)-
SpectraBase Compound ID ESiwaJJHcmq
InChI InChI=1S/C20H27BrN2O4S/c1-2-18(24)23-11-7-15-13-16(21)14-17(20(15)23)28(26,27)12-8-19(25)22-9-5-3-4-6-10-22/h13-14H,2-12H2,1H3
InChIKey STLLULFGVDISEW-UHFFFAOYSA-N
Mol Weight 471.41 g/mol
Molecular Formula C20H27BrN2O4S
Exact Mass 470.087492 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6fL53qgcKSc
Name 1H-indole, 5-bromo-7-[[3-(hexahydro-1H-azepin-1-yl)-3-oxopropyl]sulfonyl]-2,3-dihydro-1-(1-oxopropyl)-
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/C20H27BrN2O4S/c1-2-18(24)23-11-7-15-13-16(21)14-17(20(15)23)28(26,27)12-8-19(25)22-9-5-3-4-6-10-22/h13-14H,2-12H2,1H3
InChIKey STLLULFGVDISEW-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_8084
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/12258211