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methyl 5-(benzylsulfanyl)-3-hydroxy-4-(trifluoromethyl)-2-thiophenecarboxylate

View entire compound with spectra: 1 NMR

methyl 5-(benzylsulfanyl)-3-hydroxy-4-(trifluoromethyl)-2-thiophenecarboxylate
SpectraBase Compound ID 8GYsojcWAVs
InChI InChI=1S/C14H11F3O3S2/c1-20-12(19)11-10(18)9(14(15,16)17)13(22-11)21-7-8-5-3-2-4-6-8/h2-6,18H,7H2,1H3
InChIKey LMZHMVOEMFTLIM-UHFFFAOYSA-N
Mol Weight 348.35 g/mol
Molecular Formula C14H11F3O3S2
Exact Mass 348.010171 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AtkRM1i3vgm
Name methyl 5-(benzylsulfanyl)-3-hydroxy-4-(trifluoromethyl)-2-thiophenecarboxylate
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/C14H11F3O3S2/c1-20-12(19)11-10(18)9(14(15,16)17)13(22-11)21-7-8-5-3-2-4-6-8/h2-6,18H,7H2,1H3
InChIKey LMZHMVOEMFTLIM-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_1325
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: C95988; Labnumber: AKSIN-0087; SBI_ID: SBI-001327
Temperature 315 °C