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acetamide, 2-[[4,6-bis[[2-oxo-2-[[2-(trifluoromethyl)phenyl]amino]ethyl]thio]-1,3,5-triazin-2-yl]thio]-N-[2-(trifluoromethyl)phenyl]-
SpectraBase Compound ID 2HPutz2MIgm
InChI InChI=1S/C30H21F9N6O3S3/c31-28(32,33)16-7-1-4-10-19(16)40-22(46)13-49-25-43-26(50-14-23(47)41-20-11-5-2-8-17(20)29(34,35)36)45-27(44-25)51-15-24(48)42-21-12-6-3-9-18(21)30(37,38)39/h1-12H,13-15H2,(H,40,46)(H,41,47)(H,42,48)
InChIKey QPZVMPNAMYABGR-UHFFFAOYSA-N
Mol Weight 780.7 g/mol
Molecular Formula C30H21F9N6O3S3
Exact Mass 780.069356 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4kazINM3Ghd
Name acetamide, 2-[[4,6-bis[[2-oxo-2-[[2-(trifluoromethyl)phenyl]amino]ethyl]thio]-1,3,5-triazin-2-yl]thio]-N-[2-(trifluoromethyl)phenyl]-
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/C30H21F9N6O3S3/c31-28(32,33)16-7-1-4-10-19(16)40-22(46)13-49-25-43-26(50-14-23(47)41-20-11-5-2-8-17(20)29(34,35)36)45-27(44-25)51-15-24(48)42-21-12-6-3-9-18(21)30(37,38)39/h1-12H,13-15H2,(H,40,46)(H,41,47)(H,42,48)
InChIKey QPZVMPNAMYABGR-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_5696
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/6013578; Labnumber: LP-22/6509; IOH_ID: IOH-012699