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pyrimidine, 4,6-dimethyl-2-[[2-nitro-4-[(trifluoromethyl)sulfonyl]phenyl]thio]-
SpectraBase Compound ID HiqxJiCSIWQ
InChI InChI=1S/C13H10F3N3O4S2/c1-7-5-8(2)18-12(17-7)24-11-4-3-9(6-10(11)19(20)21)25(22,23)13(14,15)16/h3-6H,1-2H3
InChIKey ZCFJYEWCSVXNAQ-UHFFFAOYSA-N
Mol Weight 393.36 g/mol
Molecular Formula C13H10F3N3O4S2
Exact Mass 393.006483 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CL3BVRQ7LjL
Name pyrimidine, 4,6-dimethyl-2-[[2-nitro-4-[(trifluoromethyl)sulfonyl]phenyl]thio]-
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/C13H10F3N3O4S2/c1-7-5-8(2)18-12(17-7)24-11-4-3-9(6-10(11)19(20)21)25(22,23)13(14,15)16/h3-6H,1-2H3
InChIKey ZCFJYEWCSVXNAQ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_2364
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/11268987