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benzeneacetic acid, 4-[[(benzoylamino)carbonothioyl]amino]-alpha-hydroxy-3-methoxy-alpha-(trifluoromethyl)-, methyl ester

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benzeneacetic acid, 4-[[(benzoylamino)carbonothioyl]amino]-alpha-hydroxy-3-methoxy-alpha-(trifluoromethyl)-, methyl ester
SpectraBase Compound ID 1Ei4WqvAiK0
InChI InChI=1S/C19H17F3N2O5S/c1-28-14-10-12(18(27,16(26)29-2)19(20,21)22)8-9-13(14)23-17(30)24-15(25)11-6-4-3-5-7-11/h3-10,27H,1-2H3,(H2,23,24,25,30)
InChIKey MEMSHNWTSXAQOJ-UHFFFAOYSA-N
Mol Weight 442.41 g/mol
Molecular Formula C19H17F3N2O5S
Exact Mass 442.081027 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FvXNikTeUet
Name benzeneacetic acid, 4-[[(benzoylamino)carbonothioyl]amino]-alpha-hydroxy-3-methoxy-alpha-(trifluoromethyl)-, methyl 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/C19H17F3N2O5S/c1-28-14-10-12(18(27,16(26)29-2)19(20,21)22)8-9-13(14)23-17(30)24-15(25)11-6-4-3-5-7-11/h3-10,27H,1-2H3,(H2,23,24,25,30)
InChIKey MEMSHNWTSXAQOJ-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_CB_8313_1356
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/8325245; Labnumber: AU-EC00795
Temperature 297 °C