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benzenesulfonamide, N-butyl-5-[4-[[4-(chlorodifluoromethoxy)phenyl]amino]-1-phthalazinyl]-2-methyl-
SpectraBase Compound ID AGYicmcgFpX
InChI InChI=1S/C26H25ClF2N4O3S/c1-3-4-15-30-37(34,35)23-16-18(10-9-17(23)2)24-21-7-5-6-8-22(21)25(33-32-24)31-19-11-13-20(14-12-19)36-26(27,28)29/h5-14,16,30H,3-4,15H2,1-2H3,(H,31,33)
InChIKey BUBDENMPERETRN-UHFFFAOYSA-N
Mol Weight 547.02 g/mol
Molecular Formula C26H25ClF2N4O3S
Exact Mass 546.130396 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4iZIgK1IQkb
Name benzenesulfonamide, N-butyl-5-[4-[[4-(chlorodifluoromethoxy)phenyl]amino]-1-phthalazinyl]-2-methyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 546.130395878 u
Formula C26H25ClF2N4O3S
InChI InChI=1S/C26H25ClF2N4O3S/c1-3-4-15-30-37(34,35)23-16-18(10-9-17(23)2)24-21-7-5-6-8-22(21)25(33-32-24)31-19-11-13-20(14-12-19)36-26(27,28)29/h5-14,16,30H,3-4,15H2,1-2H3,(H,31,33)
InChIKey BUBDENMPERETRN-UHFFFAOYSA-N
Molecular Weight 547.021 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16460
Solvent DMSO-d6
Source Vendor ID: NMR/10310278; Lab Info: ZUB; Lab Number: ZUB-0001053