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3-pyridinecarbonitrile, 2-[[2-(3,4-dimethoxyphenyl)-2-oxoethyl]thio]-5-(2-thienylcarbonyl)-6-(trifluoromethyl)-
SpectraBase Compound ID ABEDdNvCTe9
InChI InChI=1S/C22H15F3N2O4S2/c1-30-16-6-5-12(9-17(16)31-2)15(28)11-33-21-13(10-26)8-14(20(27-21)22(23,24)25)19(29)18-4-3-7-32-18/h3-9H,11H2,1-2H3
InChIKey DTMYNONAQOEXJB-UHFFFAOYSA-N
Mol Weight 492.49 g/mol
Molecular Formula C22H15F3N2O4S2
Exact Mass 492.042534 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1Vm7cFFtpEU
Name 3-pyridinecarbonitrile, 2-[[2-(3,4-dimethoxyphenyl)-2-oxoethyl]thio]-5-(2-thienylcarbonyl)-6-(trifluoromethyl)-
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/C22H15F3N2O4S2/c1-30-16-6-5-12(9-17(16)31-2)15(28)11-33-21-13(10-26)8-14(20(27-21)22(23,24)25)19(29)18-4-3-7-32-18/h3-9H,11H2,1-2H3
InChIKey DTMYNONAQOEXJB-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_2232
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: F14574; Labnumber: SHEL-S0837-0062