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2-propenenitrile, 3-[(2-fluorophenyl)amino]-3-[[(3-methylphenyl)methyl]thio]-2-(phenylsulfonyl)-, (2E)-
SpectraBase Compound ID 94ZrUR6NVVK
InChI InChI=1S/C23H19FN2O2S2/c1-17-8-7-9-18(14-17)16-29-23(26-21-13-6-5-12-20(21)24)22(15-25)30(27,28)19-10-3-2-4-11-19/h2-14,26H,16H2,1H3/b23-22+
InChIKey LXFQVTXYOCYELU-GHVJWSGMSA-N
Mol Weight 438.54 g/mol
Molecular Formula C23H19FN2O2S2
Exact Mass 438.087198 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 27rxdH55MXc
Name 2-propenenitrile, 3-[(2-fluorophenyl)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 438.087198369 u
Formula C23H19FN2O2S2
InChI InChI=1S/C23H19FN2O2S2/c1-17-8-7-9-18(14-17)16-29-23(26-21-13-6-5-12-20(21)24)22(15-25)30(27,28)19-10-3-2-4-11-19/h2-14,26H,16H2,1H3/b23-22+
InChIKey LXFQVTXYOCYELU-GHVJWSGMSA-N
Molecular Weight 438.535 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_6388
Solvent DMSO-d6
Source Vendor ID: NMR/13289575