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1-acetyl-4-{[5-(2-chloro-4-nitrophenyl)-2-furyl]carbothioyl}piperazine
SpectraBase Compound ID GvtWjVNvyGM
InChI InChI=1S/C17H16ClN3O4S/c1-11(22)19-6-8-20(9-7-19)17(26)16-5-4-15(25-16)13-3-2-12(21(23)24)10-14(13)18/h2-5,10H,6-9H2,1H3
InChIKey LSURAQPKUHFPIS-UHFFFAOYSA-N
Mol Weight 393.85 g/mol
Molecular Formula C17H16ClN3O4S
Exact Mass 393.055005 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1jylMf9XuxO
Name 1-acetyl-4-{[5-(2-chloro-4-nitrophenyl)-2-furyl]carbothioyl}piperazine
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/C17H16ClN3O4S/c1-11(22)19-6-8-20(9-7-19)17(26)16-5-4-15(25-16)13-3-2-12(21(23)24)10-14(13)18/h2-5,10H,6-9H2,1H3
InChIKey LSURAQPKUHFPIS-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_21085
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: D51756; Labnumber: VLMF-0130; SBI_ID: SBI-021089
Temperature 318 °C