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5-[4-(3-chloroanilino)-1-phthalazinyl]-N-(2-hydroxy-1,1-dimethylethyl)-2-methylbenzenesulfonamide
SpectraBase Compound ID IDLhqdIJAx0
InChI InChI=1S/C25H25ClN4O3S/c1-16-11-12-17(13-22(16)34(32,33)30-25(2,3)15-31)23-20-9-4-5-10-21(20)24(29-28-23)27-19-8-6-7-18(26)14-19/h4-14,30-31H,15H2,1-3H3,(H,27,29)
InChIKey SRBUSIUQNKZTED-UHFFFAOYSA-N
Mol Weight 497.01 g/mol
Molecular Formula C25H25ClN4O3S
Exact Mass 496.13359 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JKG0zH61Svn
Name 5-[4-(3-chloroanilino)-1-phthalazinyl]-N-(2-hydroxy-1,1-dimethylethyl)-2-methylbenzenesulfonamide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C25H25ClN4O3S/c1-16-11-12-17(13-22(16)34(32,33)30-25(2,3)15-31)23-20-9-4-5-10-21(20)24(29-28-23)27-19-8-6-7-18(26)14-19/h4-14,30-31H,15H2,1-3H3,(H,27,29)
InChIKey SRBUSIUQNKZTED-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14959
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: C26481; Labnumber: RRAZ1-2355; SBI_ID: SBI-014962
Temperature 313 °C