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2-Methyl-5-[4-[4-(trifluoromethoxy)anilino]-1-phthalazinyl]benzenesulfonamide
SpectraBase Compound ID 7WMYkCfklpt
InChI InChI=1S/C22H17F3N4O3S/c1-13-6-7-14(12-19(13)33(26,30)31)20-17-4-2-3-5-18(17)21(29-28-20)27-15-8-10-16(11-9-15)32-22(23,24)25/h2-12H,1H3,(H,27,29)(H2,26,30,31)
InChIKey PFBDPTBGEWVXBZ-UHFFFAOYSA-N
Mol Weight 474.46 g/mol
Molecular Formula C22H17F3N4O3S
Exact Mass 474.097346 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GkS9uXe6SgA
Name benzenesulfonamide, 2-methyl-5-[4-[[4-(trifluoromethoxy)phenyl]amino]-1-phthalazinyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 474.097346083 u
Formula C22H17F3N4O3S
InChI InChI=1S/C22H17F3N4O3S/c1-13-6-7-14(12-19(13)33(26,30)31)20-17-4-2-3-5-18(17)21(29-28-20)27-15-8-10-16(11-9-15)32-22(23,24)25/h2-12H,1H3,(H,27,29)(H2,26,30,31)
InChIKey PFBDPTBGEWVXBZ-UHFFFAOYSA-N
Molecular Weight 474.458 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14788
Solvent DMSO-d6
Source Vendor ID: NMR/10310015; Lab Info: ZUB; Lab Number: ZUB-0000706