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3-pyridinecarbonitrile, 2-[[2-oxo-2-(2-oxo-1-pyrrolidinyl)ethyl]thio]-5-(2-thienylcarbonyl)-6-(trifluoromethyl)-
SpectraBase Compound ID AgwAybWR9dk
InChI InChI=1S/C18H12F3N3O3S2/c19-18(20,21)16-11(15(27)12-3-2-6-28-12)7-10(8-22)17(23-16)29-9-14(26)24-5-1-4-13(24)25/h2-3,6-7H,1,4-5,9H2
InChIKey CZHLWUNSQLRALN-UHFFFAOYSA-N
Mol Weight 439.43 g/mol
Molecular Formula C18H12F3N3O3S2
Exact Mass 439.027218 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID F2t06lE4TE5
Name 3-pyridinecarbonitrile, 2-[[2-oxo-2-(2-oxo-1-pyrrolidinyl)ethyl]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/C18H12F3N3O3S2/c19-18(20,21)16-11(15(27)12-3-2-6-28-12)7-10(8-22)17(23-16)29-9-14(26)24-5-1-4-13(24)25/h2-3,6-7H,1,4-5,9H2
InChIKey CZHLWUNSQLRALN-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_2246
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: F14588; Labnumber: SHEL-S0837-0077