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3-quinolinecarbonitrile, 7-(1,1-dimethylethyl)-2-[[2-(4-fluorophenyl)-2-oxoethyl]thio]-5,6,7,8-tetrahydro-4-(2-thienyl)-
SpectraBase Compound ID CNjbg06neb
InChI InChI=1S/C26H25FN2OS2/c1-26(2,3)17-8-11-19-21(13-17)29-25(20(14-28)24(19)23-5-4-12-31-23)32-15-22(30)16-6-9-18(27)10-7-16/h4-7,9-10,12,17H,8,11,13,15H2,1-3H3
InChIKey VFLNEHJFYDMHGS-UHFFFAOYSA-N
Mol Weight 464.62 g/mol
Molecular Formula C26H25FN2OS2
Exact Mass 464.139234 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 71jfmBSglaw
Name 3-quinolinecarbonitrile, 7-(1,1-dimethylethyl)-2-[[2-(4-fluorophenyl)-2-oxoethyl]thio]-5,6,7,8-tetrahydro-4-(2-thienyl)-
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/C26H25FN2OS2/c1-26(2,3)17-8-11-19-21(13-17)29-25(20(14-28)24(19)23-5-4-12-31-23)32-15-22(30)16-6-9-18(27)10-7-16/h4-7,9-10,12,17H,8,11,13,15H2,1-3H3
InChIKey VFLNEHJFYDMHGS-UHFFFAOYSA-N
NMR Offset 16.0087
NMR Spectrometer Frequency 500.133
Observed nucleus 1H
Origin 1H_ASIOH_8516_2981
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: 63TSH6.245; IOH_ID: IOH-009984