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3-Quinolinecarbonitrile, 6-ethyl-1,2,5,6,7,8-hexahydro-2-thioxo-4-(trifluoromethyl)-

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-Quinolinecarbonitrile, 6-ethyl-1,2,5,6,7,8-hexahydro-2-thioxo-4-(trifluoromethyl)-
SpectraBase Compound ID Jdi2DUlQ2tu
InChI InChI=1S/C13H13F3N2S/c1-2-7-3-4-10-8(5-7)11(13(14,15)16)9(6-17)12(19)18-10/h7H,2-5H2,1H3,(H,18,19)
InChIKey ZCTSQRJAZRMBPY-UHFFFAOYSA-N
Mol Weight 286.32 g/mol
Molecular Formula C13H13F3N2S
Exact Mass 286.075154 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FvWMbuB64EL
Name 3-quinolinecarbonitrile, 6-ethyl-5,6,7,8-tetrahydro-2-mercapto-4-(trifluoromethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 286.075154090 u
Formula C13H13F3N2S
InChI InChI=1S/C13H13F3N2S/c1-2-7-3-4-10-8(5-7)11(13(14,15)16)9(6-17)12(19)18-10/h7H,2-5H2,1H3,(H,18,19)
InChIKey ZCTSQRJAZRMBPY-UHFFFAOYSA-N
Molecular Weight 286.316 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2188
Solvent DMSO-d6
Source Vendor ID: NMR/13268409