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2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-isobutylnicotinonitrile
SpectraBase Compound ID HSfInALu3Ht
InChI InChI=1S/C18H17ClN2OS/c1-12(2)9-16-8-5-14(10-20)18(21-16)23-11-17(22)13-3-6-15(19)7-4-13/h3-8,12H,9,11H2,1-2H3
InChIKey KYOAKISLWFGWIU-UHFFFAOYSA-N
Mol Weight 344.86 g/mol
Molecular Formula C18H17ClN2OS
Exact Mass 344.075012 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BjlKsyVS4aF
Name 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-isobutylnicotinonitrile
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/C18H17ClN2OS/c1-12(2)9-16-8-5-14(10-20)18(21-16)23-11-17(22)13-3-6-15(19)7-4-13/h3-8,12H,9,11H2,1-2H3
InChIKey KYOAKISLWFGWIU-UHFFFAOYSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_17416
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: UZI/8016441; Labnumber: SAV-0000102; UZI_ID: UZI-017423
Temperature 308 °C