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(2Z)-3-(tert-butylsulfanyl)-3-(4-methoxyanilino)-2-(trifluoromethyl)-2-propenenitrile

View entire compound with spectra: 1 NMR

(2Z)-3-(tert-butylsulfanyl)-3-(4-methoxyanilino)-2-(trifluoromethyl)-2-propenenitrile
SpectraBase Compound ID FW5kJSjcxoA
InChI InChI=1S/C15H17F3N2OS/c1-14(2,3)22-13(12(9-19)15(16,17)18)20-10-5-7-11(21-4)8-6-10/h5-8,20H,1-4H3/b13-12-
InChIKey ZFKAJXHZOBHWFD-SEYXRHQNSA-N
Mol Weight 330.37 g/mol
Molecular Formula C15H17F3N2OS
Exact Mass 330.101369 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5NGDC4Obwe2
Name (2Z)-3-(tert-butylsulfanyl)-3-(4-methoxyanilino)-2-(trifluoromethyl)-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/C15H17F3N2OS/c1-14(2,3)22-13(12(9-19)15(16,17)18)20-10-5-7-11(21-4)8-6-10/h5-8,20H,1-4H3/b13-12-
InChIKey ZFKAJXHZOBHWFD-SEYXRHQNSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_1316
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: C95978; Labnumber: AKSIN-0077; SBI_ID: SBI-001318
Synonyms 3-(tert-butylsulfanyl)-3-(4-methoxyanilino)-2-(trifluoromethyl)-2-propenenitrile
Temperature 315 °C