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2-propenenitrile, 3-[(2-ethyl-6-methylphenyl)amino]-3-[[(3-methylphenyl)methyl]thio]-2-(phenylsulfonyl)-, (2E)-
SpectraBase Compound ID XsU4Aphr28
InChI InChI=1S/C26H26N2O2S2/c1-4-22-13-9-11-20(3)25(22)28-26(31-18-21-12-8-10-19(2)16-21)24(17-27)32(29,30)23-14-6-5-7-15-23/h5-16,28H,4,18H2,1-3H3/b26-24+
InChIKey QFPQHACYTFYOQU-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 4FlH7Ce2lQ3
Name 2-propenenitrile, 3-[(2-ethyl-6-methylphenyl)amino]-3-[[(3-methylphenyl)methyl]thio]-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 462.143570431 u
Formula C26H26N2O2S2
InChI InChI=1S/C26H26N2O2S2/c1-4-22-13-9-11-20(3)25(22)28-26(31-18-21-12-8-10-19(2)16-21)24(17-27)32(29,30)23-14-6-5-7-15-23/h5-16,28H,4,18H2,1-3H3/b26-24+
InChIKey QFPQHACYTFYOQU-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_4446
Solvent DMSO-d6
Source Vendor ID: NMR/13288056