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benzeneacetic acid, 4-[[(benzoylamino)carbonothioyl]amino]-alpha-hydroxy-3-methoxy-alpha-(trifluoromethyl)-, ethyl ester
SpectraBase Compound ID 2t0JTPMtqdk
InChI InChI=1S/C20H19F3N2O5S/c1-3-30-17(27)19(28,20(21,22)23)13-9-10-14(15(11-13)29-2)24-18(31)25-16(26)12-7-5-4-6-8-12/h4-11,28H,3H2,1-2H3,(H2,24,25,26,31)
InChIKey DBCVRVPNYQFENX-UHFFFAOYSA-N
Mol Weight 456.44 g/mol
Molecular Formula C20H19F3N2O5S
Exact Mass 456.096677 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1HqlNg2XbFv
Name benzeneacetic acid, 4-[[(benzoylamino)carbonothioyl]amino]-alpha-hydroxy-3-methoxy-alpha-(trifluoromethyl)-, ethyl 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/C20H19F3N2O5S/c1-3-30-17(27)19(28,20(21,22)23)13-9-10-14(15(11-13)29-2)24-18(31)25-16(26)12-7-5-4-6-8-12/h4-11,28H,3H2,1-2H3,(H2,24,25,26,31)
InChIKey DBCVRVPNYQFENX-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_CB_8313_1357
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/8325246; Labnumber: AU-EC00796
Temperature 297 °C