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[1,2,4]triazolo[4,3-b]pyridazine, 6-[4-[(4-methoxyphenyl)sulfonyl]-1-piperazinyl]-3-phenyl-
SpectraBase Compound ID LSwimFwWFf0
InChI InChI=1S/C22H22N6O3S/c1-31-18-7-9-19(10-8-18)32(29,30)27-15-13-26(14-16-27)21-12-11-20-23-24-22(28(20)25-21)17-5-3-2-4-6-17/h2-12H,13-16H2,1H3
InChIKey KPQBNFFZNNXBIG-UHFFFAOYSA-N
Mol Weight 450.52 g/mol
Molecular Formula C22H22N6O3S
Exact Mass 450.14741 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5ldkV3AR3GO
Name [1,2,4]triazolo[4,3-b]pyridazine, 6-[4-[(4-methoxyphenyl)sulfonyl]-1-piperazinyl]-3-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 450.147409763 u
Formula C22H22N6O3S
InChI InChI=1S/C22H22N6O3S/c1-31-18-7-9-19(10-8-18)32(29,30)27-15-13-26(14-16-27)21-12-11-20-23-24-22(28(20)25-21)17-5-3-2-4-6-17/h2-12H,13-16H2,1H3
InChIKey KPQBNFFZNNXBIG-UHFFFAOYSA-N
Molecular Weight 450.517 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_3400
Solvent DMSO-d6
Source Vendor ID: NMR/12689959