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3(2H)-Pyridazinone, 2-phenyl-4,5-bis[(phenylmethyl)thio]-
SpectraBase Compound ID 6WByMgpFQsX
InChI InChI=1S/C24H20N2OS2/c27-24-23(29-18-20-12-6-2-7-13-20)22(28-17-19-10-4-1-5-11-19)16-25-26(24)21-14-8-3-9-15-21/h1-16H,17-18H2
InChIKey GBLGVAZRPHWBIU-UHFFFAOYSA-N
Mol Weight 416.56 g/mol
Molecular Formula C24H20N2OS2
Exact Mass 416.101706 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FiQ7N6aXqCU
Name 3(2H)-Pyridazinone, 2-phenyl-4,5-bis[(phenylmethyl)thio]-; 3(2H)-pyridazinone, 4,5-bis(benzylthio)-2-phenyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 416.101705619 u
Formula C24H20N2OS2
InChI InChI=1S/C24H20N2OS2/c27-24-23(29-18-20-12-6-2-7-13-20)22(28-17-19-10-4-1-5-11-19)16-25-26(24)21-14-8-3-9-15-21/h1-16H,17-18H2
InChIKey GBLGVAZRPHWBIU-UHFFFAOYSA-N
Molecular Weight 416.557 g/mol
SMILES C=1C(=C(C(N(N1)C1=CC=CC=C1)=O)SCC1=CC=CC=C1)SCC1=CC=CC=C1