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(2E)-2-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-3-{2-[(trifluoromethyl)sulfanyl]anilino}-2-propenenitrile
SpectraBase Compound ID 1pZZaWaoe2g
InChI InChI=1S/C21H16F3N3S2/c1-2-14-7-9-15(10-8-14)18-13-28-20(27-18)16(11-25)12-26-17-5-3-4-6-19(17)29-21(22,23)24/h3-10,12-13,26H,2H2,1H3/b16-12+
InChIKey KDJNYDXTDZHQJA-FOWTUZBSSA-N
Mol Weight 431.5 g/mol
Molecular Formula C21H16F3N3S2
Exact Mass 431.073774 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HHN9vOFPid5
Name (2E)-2-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-3-{2-[(trifluoromethyl)sulfanyl]anilino}-2-propenenitrile
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H16F3N3S2/c1-2-14-7-9-15(10-8-14)18-13-28-20(27-18)16(11-25)12-26-17-5-3-4-6-19(17)29-21(22,23)24/h3-10,12-13,26H,2H2,1H3/b16-12+
InChIKey KDJNYDXTDZHQJA-FOWTUZBSSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_4759
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 121543; Labnumber: ULGAP-10-1421; VK_ID: VK-004760
Synonyms 2-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-3-{2-[(trifluoromethyl)sulfanyl]anilino}-2-propenenitrile
Temperature 315 °C