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2-{[2-oxo-2-(1-pyrrolidinyl)ethyl]sulfanyl}-5-(trifluoromethyl)-1,3-benzothiazole
SpectraBase Compound ID 6SDx3gcLwmp
InChI InChI=1S/C14H13F3N2OS2/c15-14(16,17)9-3-4-11-10(7-9)18-13(22-11)21-8-12(20)19-5-1-2-6-19/h3-4,7H,1-2,5-6,8H2
InChIKey JOFFOCMIDADOSR-UHFFFAOYSA-N
Mol Weight 346.39 g/mol
Molecular Formula C14H13F3N2OS2
Exact Mass 346.04214 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GTtCjfNw2Vp
Name 2-{[2-oxo-2-(1-pyrrolidinyl)ethyl]sulfanyl}-5-(trifluoromethyl)-1,3-benzothiazole
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/C14H13F3N2OS2/c15-14(16,17)9-3-4-11-10(7-9)18-13(22-11)21-8-12(20)19-5-1-2-6-19/h3-4,7H,1-2,5-6,8H2
InChIKey JOFFOCMIDADOSR-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_6013
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: NMR/11241713; Labnumber: LP-2110589; IOH_ID: IOH-006014
Synonyms 2-oxo-2-(1-pyrrolidinyl)ethyl 5-(trifluoromethyl)-1,3-benzothiazol-2-yl sulfide