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1-piperazinecarbothioamide, N-phenyl-4-(3-phenyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-
SpectraBase Compound ID K8rA0gQFkew
InChI InChI=1S/C22H21N7S/c30-22(23-18-9-5-2-6-10-18)28-15-13-27(14-16-28)20-12-11-19-24-25-21(29(19)26-20)17-7-3-1-4-8-17/h1-12H,13-16H2,(H,23,30)
InChIKey HAZLBVORFQCVAJ-UHFFFAOYSA-N
Mol Weight 415.52 g/mol
Molecular Formula C22H21N7S
Exact Mass 415.157915 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID F1iBHrFVOp6
Name 1-piperazinecarbothioamide, N-phenyl-4-(3-phenyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 415.157914878 u
Formula C22H21N7S
InChI InChI=1S/C22H21N7S/c30-22(23-18-9-5-2-6-10-18)28-15-13-27(14-16-28)20-12-11-19-24-25-21(29(19)26-20)17-7-3-1-4-8-17/h1-12H,13-16H2,(H,23,30)
InChIKey HAZLBVORFQCVAJ-UHFFFAOYSA-N
Molecular Weight 415.519 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2924
Solvent DMSO-d6
Source Vendor ID: NMR/12689592