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alanine, N-acetyl-3,3,3-trifluoro-2-[[4-[(2-thiazolylamino)sulfonyl]phenyl]amino]-, ethyl ester
SpectraBase Compound ID GD0UMAk3TTQ
InChI InChI=1S/C16H17F3N4O5S2/c1-3-28-13(25)15(16(17,18)19,21-10(2)24)22-11-4-6-12(7-5-11)30(26,27)23-14-20-8-9-29-14/h4-9,22H,3H2,1-2H3,(H,20,23)(H,21,24)
InChIKey LPKLGOCTNJJASZ-UHFFFAOYSA-N
Mol Weight 466.45 g/mol
Molecular Formula C16H17F3N4O5S2
Exact Mass 466.059246 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2EfrP4iRPC8
Name alanine, N-acetyl-3,3,3-trifluoro-2-[[4-[(2-thiazolylamino)sulfonyl]phenyl]amino]-, 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/C16H17F3N4O5S2/c1-3-28-13(25)15(16(17,18)19,21-10(2)24)22-11-4-6-12(7-5-11)30(26,27)23-14-20-8-9-29-14/h4-9,22H,3H2,1-2H3,(H,20,23)(H,21,24)
InChIKey LPKLGOCTNJJASZ-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_CB_8313_1594
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/9213064; Labnumber: AU-F000426
Temperature 303 °C