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carbamothioic acid, methyl(phenyl)-, O-[4-[[(4-iodophenyl)amino]carbonyl]phenyl] ester
SpectraBase Compound ID G9Bdl9BYCjY
InChI InChI=1S/C21H17IN2O2S/c1-24(18-5-3-2-4-6-18)21(27)26-19-13-7-15(8-14-19)20(25)23-17-11-9-16(22)10-12-17/h2-14H,1H3,(H,23,25)
InChIKey CMMUZZITHLZSJD-UHFFFAOYSA-N
Mol Weight 488.34 g/mol
Molecular Formula C21H17IN2O2S
Exact Mass 488.005544 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ByypMX76nRd
Name carbamothioic acid, methyl(phenyl)-, O-[4-[[(4-iodophenyl)amino]carbonyl]phenyl] 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/C21H17IN2O2S/c1-24(18-5-3-2-4-6-18)21(27)26-19-13-7-15(8-14-19)20(25)23-17-11-9-16(22)10-12-17/h2-14H,1H3,(H,23,25)
InChIKey CMMUZZITHLZSJD-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_6667
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/6061334; Labnumber: LD-06; IOH_ID: IOH-013671