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3-(4-{[5-(2-chloro-4-nitrophenyl)-2-furyl]carbothioyl}-1-piperazinyl)propanenitrile
SpectraBase Compound ID zX9RmPtNul
InChI InChI=1S/C18H17ClN4O3S/c19-15-12-13(23(24)25)2-3-14(15)16-4-5-17(26-16)18(27)22-10-8-21(9-11-22)7-1-6-20/h2-5,12H,1,7-11H2
InChIKey QERNRVHPRHPYOT-UHFFFAOYSA-N
Mol Weight 404.87 g/mol
Molecular Formula C18H17ClN4O3S
Exact Mass 404.070989 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CQv9jBy4q8P
Name 3-(4-{[5-(2-chloro-4-nitrophenyl)-2-furyl]carbothioyl}-1-piperazinyl)propanenitrile
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/C18H17ClN4O3S/c19-15-12-13(23(24)25)2-3-14(15)16-4-5-17(26-16)18(27)22-10-8-21(9-11-22)7-1-6-20/h2-5,12H,1,7-11H2
InChIKey QERNRVHPRHPYOT-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_21086
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: D51757; Labnumber: VLMF-0131; SBI_ID: SBI-021090
Temperature 318 °C