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1-[4-(4-Chloro-phenylsulfanyl)-3,5,6-trifluoro-pyridin-2-yl]-piperazine
SpectraBase Compound ID yWJIZZzOzp
InChI InChI=1S/C15H13ClF3N3S/c16-9-1-3-10(4-2-9)23-13-11(17)14(19)21-15(12(13)18)22-7-5-20-6-8-22/h1-4,20H,5-8H2
InChIKey ZZITYBWBAALKMX-UHFFFAOYSA-N
Mol Weight 359.8 g/mol
Molecular Formula C15H13ClF3N3S
Exact Mass 359.047081 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EcFua8ZhN4E
Name piperazine, 1-[4-[(4-chlorophenyl)thio]-3,5,6-trifluoro-2-pyridinyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 359.047080794 u
Formula C15H13ClF3N3S
InChI InChI=1S/C15H13ClF3N3S/c16-9-1-3-10(4-2-9)23-13-11(17)14(19)21-15(12(13)18)22-7-5-20-6-8-22/h1-4,20H,5-8H2
InChIKey ZZITYBWBAALKMX-UHFFFAOYSA-N
Molecular Weight 359.798 g/mol
NMR Offset 17.9879
NMR Spectrometer Frequency 500.132
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16126
Solvent CDCl3
Source Vendor ID: NMR/10301493; Lab Info: SIP; Lab Number: SIP-0053