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2-(3-Fluoro-benzyl)-2H-naphtho[1,8-cd]isothiazole 1,1-dioxide
SpectraBase Compound ID 1CPlKiclTce
InChI InChI=1S/C17H12FNO2S/c18-14-7-1-4-12(10-14)11-19-15-8-2-5-13-6-3-9-16(17(13)15)22(19,20)21/h1-10H,11H2
InChIKey GRMJJJVPPFTIJT-UHFFFAOYSA-N
Mol Weight 313.35 g/mol
Molecular Formula C17H12FNO2S
Exact Mass 313.057278 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6inAg18i5si
Name 2H-naphtho[1,8-cd]isothiazole, 2-[(3-fluorophenyl)methyl]-, 1,1-dioxide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 313.057277965 u
Formula C17H12FNO2S
InChI InChI=1S/C17H12FNO2S/c18-14-7-1-4-12(10-14)11-19-15-8-2-5-13-6-3-9-16(17(13)15)22(19,20)21/h1-10H,11H2
InChIKey GRMJJJVPPFTIJT-UHFFFAOYSA-N
Molecular Weight 313.346 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17539
Solvent DMSO-d6
Source Vendor ID: NMR/10322001; Lab Info: SAD; Lab Number: 2657