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benzamide, 2-chloro-N-(3-cyano-4,5,6,7-tetrahydrobenzo[b]thien-2-yl)-5-(1-piperidinylsulfonyl)-
SpectraBase Compound ID EF46SIgmFbH
InChI InChI=1S/C21H22ClN3O3S2/c22-18-9-8-14(30(27,28)25-10-4-1-5-11-25)12-16(18)20(26)24-21-17(13-23)15-6-2-3-7-19(15)29-21/h8-9,12H,1-7,10-11H2,(H,24,26)
InChIKey LVXCLZQHYKWOQU-UHFFFAOYSA-N
Mol Weight 464.0 g/mol
Molecular Formula C21H22ClN3O3S2
Exact Mass 463.079112 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HyyRrhYsPwF
Name benzamide, 2-chloro-N-(3-cyano-4,5,6,7-tetrahydrobenzo[b]thien-2-yl)-5-(1-piperidinylsulfonyl)-
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/C21H22ClN3O3S2/c22-18-9-8-14(30(27,28)25-10-4-1-5-11-25)12-16(18)20(26)24-21-17(13-23)15-6-2-3-7-19(15)29-21/h8-9,12H,1-7,10-11H2,(H,24,26)
InChIKey LVXCLZQHYKWOQU-UHFFFAOYSA-N
NMR Offset 15.2038
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_8516_312
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/5120224; Labnumber: SP-1156; IOH_ID: IOH-007313
Temperature 313 °C