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methyl 2-{[4-(dimethylamino)phenyl]sulfanyl}-2,3,3,3-tetrafluoropropanoate
SpectraBase Compound ID 9i1kETIqJyD
InChI InChI=1S/C12H13F4NO2S/c1-17(2)8-4-6-9(7-5-8)20-11(13,10(18)19-3)12(14,15)16/h4-7H,1-3H3
InChIKey ZFFGUPOLGSGCLK-UHFFFAOYSA-N
Mol Weight 311.29 g/mol
Molecular Formula C12H13F4NO2S
Exact Mass 311.060312 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A7dyhPk02fo
Name methyl 2-{[4-(dimethylamino)phenyl]sulfanyl}-2,3,3,3-tetrafluoropropanoate
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/C12H13F4NO2S/c1-17(2)8-4-6-9(7-5-8)20-11(13,10(18)19-3)12(14,15)16/h4-7H,1-3H3
InChIKey ZFFGUPOLGSGCLK-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_280
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: C27560; Labnumber: AKSIN-0003; SBI_ID: SBI-000282
Temperature 306 °C