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4-chloro-3-(hexahydro-1H-azepin-1-ylsulfonyl)-N-(4-iodophenyl)benzamide

View entire compound with spectra: 1 NMR

4-chloro-3-(hexahydro-1H-azepin-1-ylsulfonyl)-N-(4-iodophenyl)benzamide
SpectraBase Compound ID 8rWbMDndl9C
InChI InChI=1S/C19H20ClIN2O3S/c20-17-10-5-14(19(24)22-16-8-6-15(21)7-9-16)13-18(17)27(25,26)23-11-3-1-2-4-12-23/h5-10,13H,1-4,11-12H2,(H,22,24)
InChIKey GHANYJPHBFBLJY-UHFFFAOYSA-N
Mol Weight 518.8 g/mol
Molecular Formula C19H20ClIN2O3S
Exact Mass 517.992786 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9gvp8GA27WH
Name 4-chloro-3-(hexahydro-1H-azepin-1-ylsulfonyl)-N-(4-iodophenyl)benzamide
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/C19H20ClIN2O3S/c20-17-10-5-14(19(24)22-16-8-6-15(21)7-9-16)13-18(17)27(25,26)23-11-3-1-2-4-12-23/h5-10,13H,1-4,11-12H2,(H,22,24)
InChIKey GHANYJPHBFBLJY-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_3727
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: ZI/7085318; Labnumber: SP-0001728; IOH_ID: IOH-003728
Temperature 297 °C