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2-propenenitrile, 3-[[(2-fluorophenyl)methyl]thio]-2-(phenylsulfonyl)-3-[(2,4,6-trimethylphenyl)amino]-, (2E)-
SpectraBase Compound ID Kquimoppwgd
InChI InChI=1S/C25H23FN2O2S2/c1-17-13-18(2)24(19(3)14-17)28-25(31-16-20-9-7-8-12-22(20)26)23(15-27)32(29,30)21-10-5-4-6-11-21/h4-14,28H,16H2,1-3H3/b25-23+
InChIKey MKJFRKUVVORHRE-WJTDDFOZSA-N
Mol Weight 466.59 g/mol
Molecular Formula C25H23FN2O2S2
Exact Mass 466.118498 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JS8UbxoNZky
Name 2-propenenitrile, 3-[[(2-fluorophenyl)methyl]thio]-2-(phenylsulfonyl)-3-[(2,4,6-trimethylphenyl)amino]-, (2E)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 466.118498498 u
Formula C25H23FN2O2S2
InChI InChI=1S/C25H23FN2O2S2/c1-17-13-18(2)24(19(3)14-17)28-25(31-16-20-9-7-8-12-22(20)26)23(15-27)32(29,30)21-10-5-4-6-11-21/h4-14,28H,16H2,1-3H3/b25-23+
InChIKey MKJFRKUVVORHRE-WJTDDFOZSA-N
Molecular Weight 466.589 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_4461
Solvent DMSO-d6
Source Vendor ID: NMR/13288078