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3-penten-2-one, 3-[[3-(4-fluorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]thio]-4-hydroxy-, (3E)-
SpectraBase Compound ID KzOsWmmpJjn
InChI InChI=1S/C16H13FN4O2S/c1-9(22)15(10(2)23)24-14-8-7-13-18-19-16(21(13)20-14)11-3-5-12(17)6-4-11/h3-8,22H,1-2H3/b15-9+
InChIKey YYDYPEKRAQALRR-OQLLNIDSSA-N
Mol Weight 344.36 g/mol
Molecular Formula C16H13FN4O2S
Exact Mass 344.074325 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6VmFB93KnO
Name 3-penten-2-one, 3-[[3-(4-fluorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]thio]-4-hydroxy-, (3E)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 344.074325010 u
Formula C16H13FN4O2S
InChI InChI=1S/C16H13FN4O2S/c1-9(22)15(10(2)23)24-14-8-7-13-18-19-16(21(13)20-14)11-3-5-12(17)6-4-11/h3-8,22H,1-2H3/b15-9+
InChIKey YYDYPEKRAQALRR-OQLLNIDSSA-N
Molecular Weight 344.364 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_8497
Solvent DMSO-d6
Source Vendor ID: NMR/13309444