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2-propenenitrile, 3-[[(3-methylphenyl)methyl]thio]-2-(phenylsulfonyl)-3-[(2,4,6-trimethylphenyl)amino]-, (2E)-
SpectraBase Compound ID 3lU4Rvzbxsu
InChI InChI=1S/C26H26N2O2S2/c1-18-9-8-10-22(15-18)17-31-26(28-25-20(3)13-19(2)14-21(25)4)24(16-27)32(29,30)23-11-6-5-7-12-23/h5-15,28H,17H2,1-4H3/b26-24+
InChIKey JSLHXTGZNKZYHE-SHHOIMCASA-N
Mol Weight 462.63 g/mol
Molecular Formula C26H26N2O2S2
Exact Mass 462.14357 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FatdS3m69PI
Name 2-propenenitrile, 3-[[(3-methylphenyl)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 462.143570431 u
Formula C26H26N2O2S2
InChI InChI=1S/C26H26N2O2S2/c1-18-9-8-10-22(15-18)17-31-26(28-25-20(3)13-19(2)14-21(25)4)24(16-27)32(29,30)23-11-6-5-7-12-23/h5-15,28H,17H2,1-4H3/b26-24+
InChIKey JSLHXTGZNKZYHE-SHHOIMCASA-N
Molecular Weight 462.626 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_4464
Solvent DMSO-d6
Source Vendor ID: NMR/13288082