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2-propenenitrile, 3-[[(4-methylphenyl)methyl]thio]-3-[[3-(methylthio)phenyl]amino]-2-(phenylsulfonyl)-, (2E)-
SpectraBase Compound ID ISc9Ruugpso
InChI InChI=1S/C24H22N2O2S3/c1-18-11-13-19(14-12-18)17-30-24(26-20-7-6-8-21(15-20)29-2)23(16-25)31(27,28)22-9-4-3-5-10-22/h3-15,26H,17H2,1-2H3/b24-23+
InChIKey JMGUZVQNAAMAMS-WCWDXBQESA-N
Mol Weight 466.63 g/mol
Molecular Formula C24H22N2O2S3
Exact Mass 466.084341 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8elfBHlij1I
Name 2-propenenitrile, 3-[[(4-methylphenyl)methyl]thio]-3-[[3-(methylthio)phenyl]amino]-2-(phenylsulfonyl)-, (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 466.084341476 u
Formula C24H22N2O2S3
InChI InChI=1S/C24H22N2O2S3/c1-18-11-13-19(14-12-18)17-30-24(26-20-7-6-8-21(15-20)29-2)23(16-25)31(27,28)22-9-4-3-5-10-22/h3-15,26H,17H2,1-2H3/b24-23+
InChIKey JMGUZVQNAAMAMS-WCWDXBQESA-N
Molecular Weight 466.632 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_6417
Solvent DMSO-d6
Source Vendor ID: NMR/13289608