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3,5-bis{[2-oxo-2-(1-piperidinyl)ethyl]sulfanyl}-4-isothiazolecarbonitrile

View entire compound with spectra: 1 NMR

3,5-bis{[2-oxo-2-(1-piperidinyl)ethyl]sulfanyl}-4-isothiazolecarbonitrile
SpectraBase Compound ID 5Qnw5Ay6WoL
InChI InChI=1S/C18H24N4O2S3/c19-11-14-17(25-12-15(23)21-7-3-1-4-8-21)20-27-18(14)26-13-16(24)22-9-5-2-6-10-22/h1-10,12-13H2
InChIKey ZCYHIPGOHRZSKZ-UHFFFAOYSA-N
Mol Weight 424.6 g/mol
Molecular Formula C18H24N4O2S3
Exact Mass 424.10614 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JwPfpoehui9
Name 3,5-bis{[2-oxo-2-(1-piperidinyl)ethyl]sulfanyl}-4-isothiazolecarbonitrile
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/C18H24N4O2S3/c19-11-14-17(25-12-15(23)21-7-3-1-4-8-21)20-27-18(14)26-13-16(24)22-9-5-2-6-10-22/h1-10,12-13H2
InChIKey ZCYHIPGOHRZSKZ-UHFFFAOYSA-N
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_2707
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: NMR/9296399; Labnumber: NKS-aca0075