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N-(2,6-difluorobenzoyl)-N'-{2-[(1,1,2,2,2-pentafluoroethyl)sulfanyl]phenyl}urea
SpectraBase Compound ID CGXZKMCclD7
InChI InChI=1S/C16H9F7N2O2S/c17-8-4-3-5-9(18)12(8)13(26)25-14(27)24-10-6-1-2-7-11(10)28-16(22,23)15(19,20)21/h1-7H,(H2,24,25,26,27)
InChIKey LGTQKCOWVXLPKJ-UHFFFAOYSA-N
Mol Weight 426.31 g/mol
Molecular Formula C16H9F7N2O2S
Exact Mass 426.027296 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FUU4S1dkgNh
Name urea, N-(2,6-difluorobenzoyl)-N'-[2-[(1,1,2,2,2-pentafluoroethyl)thio]phenyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 426.027295851 u
Formula C16H9F7N2O2S
InChI InChI=1S/C16H9F7N2O2S/c17-8-4-3-5-9(18)12(8)13(26)25-14(27)24-10-6-1-2-7-11(10)28-16(22,23)15(19,20)21/h1-7H,(H2,24,25,26,27)
InChIKey LGTQKCOWVXLPKJ-UHFFFAOYSA-N
Molecular Weight 426.309 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17230
Solvent DMSO-d6
Source Vendor ID: NMR/10301743; Lab Info: SIP; Lab Number: SIP-145