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2-bromo-6-methoxy-4-(1-piperidinylcarbothioyl)phenyl 4-methylbenzenesulfonate

View entire compound with spectra: 1 NMR

2-bromo-6-methoxy-4-(1-piperidinylcarbothioyl)phenyl 4-methylbenzenesulfonate
SpectraBase Compound ID DEpGThjdB6Z
InChI InChI=1S/C20H22BrNO4S2/c1-14-6-8-16(9-7-14)28(23,24)26-19-17(21)12-15(13-18(19)25-2)20(27)22-10-4-3-5-11-22/h6-9,12-13H,3-5,10-11H2,1-2H3
InChIKey VLHXJHWUNHBXBD-UHFFFAOYSA-N
Mol Weight 484.42 g/mol
Molecular Formula C20H22BrNO4S2
Exact Mass 483.017364 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5axC2Vf5Rpx
Name 2-bromo-6-methoxy-4-(1-piperidinylcarbothioyl)phenyl 4-methylbenzenesulfonate
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/C20H22BrNO4S2/c1-14-6-8-16(9-7-14)28(23,24)26-19-17(21)12-15(13-18(19)25-2)20(27)22-10-4-3-5-11-22/h6-9,12-13H,3-5,10-11H2,1-2H3
InChIKey VLHXJHWUNHBXBD-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7529_530
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/8047834; Labnumber: LD-0500170
Temperature 303 °C