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2-Hydroxy-2-(trifluoromethyl)-2H-1,4-benzothiazin-3(4H)-one
SpectraBase Compound ID LXljEc5vNK0
InChI InChI=1S/C9H6F3NO2S/c10-9(11,12)8(15)7(14)13-5-3-1-2-4-6(5)16-8/h1-4,15H,(H,13,14)
InChIKey KHRNGIQQQUTMTJ-UHFFFAOYSA-N
Mol Weight 249.21 g/mol
Molecular Formula C9H6F3NO2S
Exact Mass 249.007134 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LTP59Q8dTf7
Name 2H-1,4-benzothiazin-3(4H)-one, 2-hydroxy-2-(trifluoromethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 249.007134098 u
Formula C9H6F3NO2S
InChI InChI=1S/C9H6F3NO2S/c10-9(11,12)8(15)7(14)13-5-3-1-2-4-6(5)16-8/h1-4,15H,(H,13,14)
InChIKey KHRNGIQQQUTMTJ-UHFFFAOYSA-N
Molecular Weight 249.207 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17369
Solvent DMSO-d6
Source Vendor ID: ZI/10035787; Lab Info: DYA; Lab Number: DYA-0000169