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1-piperazinecarbothioamide, 4-[3-(4-fluorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-N-phenyl-
SpectraBase Compound ID bV8LMaCh1O
InChI InChI=1S/C22H20FN7S/c23-17-8-6-16(7-9-17)21-26-25-19-10-11-20(27-30(19)21)28-12-14-29(15-13-28)22(31)24-18-4-2-1-3-5-18/h1-11H,12-15H2,(H,24,31)
InChIKey SPWHVEILZNFXQW-UHFFFAOYSA-N
Mol Weight 433.51 g/mol
Molecular Formula C22H20FN7S
Exact Mass 433.148493 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E1FkItn9vMk
Name 1-piperazinecarbothioamide, 4-[3-(4-fluorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-N-phenyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 433.148493009 u
Formula C22H20FN7S
InChI InChI=1S/C22H20FN7S/c23-17-8-6-16(7-9-17)21-26-25-19-10-11-20(27-30(19)21)28-12-14-29(15-13-28)22(31)24-18-4-2-1-3-5-18/h1-11H,12-15H2,(H,24,31)
InChIKey SPWHVEILZNFXQW-UHFFFAOYSA-N
Molecular Weight 433.509 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2912
Solvent DMSO-d6
Source Vendor ID: NMR/12689578