1-[4-[5-(4-chloranyl-2-nitro-phenyl)furan-2-yl]carbothioylpiperazin-1-yl]ethanone

SpectraBase Compound ID	F4kwnph7cbm
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(18)10-14(13)21(23)24/h2-5,10H,6-9H2,1H3
InChIKey	XBEWIFVIPGJNJM-UHFFFAOYSA-N Google Search
Mol Weight	393.85 g/mol
Molecular Formula	C17H16ClN3O4S
Exact Mass	393.055005 g/mol

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SpectraBase Spectrum ID	INT7axxdRaj
Name	piperazine, 1-acetyl-4-[[5-(4-chloro-2-nitrophenyl)-2-furanyl]carbonothioyl]-
Copyright	Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	393.055004877 u
Formula	C17H16ClN3O4S
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(18)10-14(13)21(23)24/h2-5,10H,6-9H2,1H3
InChIKey	XBEWIFVIPGJNJM-UHFFFAOYSA-N
Molecular Weight	393.845 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_13459
Solvent	DMSO-d6
Source	Vendor ID: NMR/10301651; Lab Info: MIZ; Lab Number: MIZ-L000198