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[1,2,4]triazolo[4,3-b]pyridazine, 3-(4-fluorophenyl)-6-[4-[(4-methylphenyl)sulfonyl]-1-piperazinyl]-
SpectraBase Compound ID 2oRUCjGc8xg
InChI InChI=1S/C22H21FN6O2S/c1-16-2-8-19(9-3-16)32(30,31)28-14-12-27(13-15-28)21-11-10-20-24-25-22(29(20)26-21)17-4-6-18(23)7-5-17/h2-11H,12-15H2,1H3
InChIKey IZVQVRAXNFSMLH-UHFFFAOYSA-N
Mol Weight 452.51 g/mol
Molecular Formula C22H21FN6O2S
Exact Mass 452.143073 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HNRiR0e8dhu
Name [1,2,4]triazolo[4,3-b]pyridazine, 3-(4-fluorophenyl)-6-[4-[(4-methylphenyl)sulfonyl]-1-piperazinyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 452.143073275 u
Formula C22H21FN6O2S
InChI InChI=1S/C22H21FN6O2S/c1-16-2-8-19(9-3-16)32(30,31)28-14-12-27(13-15-28)21-11-10-20-24-25-22(29(20)26-21)17-4-6-18(23)7-5-17/h2-11H,12-15H2,1H3
InChIKey IZVQVRAXNFSMLH-UHFFFAOYSA-N
Molecular Weight 452.508 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_3407
Solvent DMSO-d6
Source Vendor ID: NMR/12689967