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2-(Butylsulfanyl)-4-(4-fluorophenyl)-6-phenylnicotinonitrile

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

2-(Butylsulfanyl)-4-(4-fluorophenyl)-6-phenylnicotinonitrile
SpectraBase Compound ID 3WgjokwTfAi
InChI InChI=1S/C22H19FN2S/c1-2-3-13-26-22-20(15-24)19(16-9-11-18(23)12-10-16)14-21(25-22)17-7-5-4-6-8-17/h4-12,14H,2-3,13H2,1H3
InChIKey VVTMHWBWRQTDMZ-UHFFFAOYSA-N
Mol Weight 362.47 g/mol
Molecular Formula C22H19FN2S
Exact Mass 362.125298 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IfI12OWIZlu
Name 2-(butylsulfanyl)-4-(4-fluorophenyl)-6-phenylnicotinonitrile
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/C22H19FN2S/c1-2-3-13-26-22-20(15-24)19(16-9-11-18(23)12-10-16)14-21(25-22)17-7-5-4-6-8-17/h4-12,14H,2-3,13H2,1H3
InChIKey VVTMHWBWRQTDMZ-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_9159
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: S10760; Labnumber: MOR-1977; VK_ID: VK-009163
Temperature 308 °C