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3-tert-Butylsulfanyl-3-(4-ethyl-phenylamino)-2-trifluoromethyl-acrylic acid methyl ester
SpectraBase Compound ID Lp9AAHB8sgV
InChI InChI=1S/C17H22F3NO2S/c1-6-11-7-9-12(10-8-11)21-14(24-16(2,3)4)13(15(22)23-5)17(18,19)20/h7-10,21H,6H2,1-5H3/b14-13-
InChIKey AMORTQAJLDOVOW-YPKPFQOOSA-N
Mol Weight 361.42 g/mol
Molecular Formula C17H22F3NO2S
Exact Mass 361.132335 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E76Nk3SRmCJ
Name methyl (2Z)-3-(tert-butylsulfanyl)-3-(4-ethylanilino)-2-(trifluoromethyl)-2-propenoate
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/C17H22F3NO2S/c1-6-11-7-9-12(10-8-11)21-14(24-16(2,3)4)13(15(22)23-5)17(18,19)20/h7-10,21H,6H2,1-5H3/b14-13-
InChIKey AMORTQAJLDOVOW-YPKPFQOOSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_1313
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: C95975; Labnumber: AKSIN-0074; SBI_ID: SBI-001315
Synonyms methyl 3-(tert-butylsulfanyl)-3-(4-ethylanilino)-2-(trifluoromethyl)-2-propenoate
Temperature 315 °C