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2-propenenitrile, 3-[[(2-chlorophenyl)methyl]thio]-3-[(2,5-dimethylphenyl)amino]-2-(phenylsulfonyl)-, (2E)-
SpectraBase Compound ID DOZ2Qw7Ym6y
InChI InChI=1S/C24H21ClN2O2S2/c1-17-12-13-18(2)22(14-17)27-24(30-16-19-8-6-7-11-21(19)25)23(15-26)31(28,29)20-9-4-3-5-10-20/h3-14,27H,16H2,1-2H3/b24-23+
InChIKey OHJCZDRVELZHBQ-WCWDXBQESA-N
Mol Weight 469.02 g/mol
Molecular Formula C24H21ClN2O2S2
Exact Mass 468.073298 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KsHbaRwexIp
Name 2-propenenitrile, 3-[[(2-chlorophenyl)methyl]thio]-3-[(2,5-dimethylphenyl)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 468.073297970 u
Formula C24H21ClN2O2S2
InChI InChI=1S/C24H21ClN2O2S2/c1-17-12-13-18(2)22(14-17)27-24(30-16-19-8-6-7-11-21(19)25)23(15-26)31(28,29)20-9-4-3-5-10-20/h3-14,27H,16H2,1-2H3/b24-23+
InChIKey OHJCZDRVELZHBQ-WCWDXBQESA-N
Molecular Weight 469.017 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_4458
Solvent DMSO-d6
Source Vendor ID: NMR/13288072