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4-{[4-(3-{[(2-hydroxy-1,1-dimethylethyl)amino]sulfonyl}-4-methylphenyl)-1-phthalazinyl]amino}benzamide
SpectraBase Compound ID KNgkinhrmnV
InChI InChI=1S/C26H27N5O4S/c1-16-8-9-18(14-22(16)36(34,35)31-26(2,3)15-32)23-20-6-4-5-7-21(20)25(30-29-23)28-19-12-10-17(11-13-19)24(27)33/h4-14,31-32H,15H2,1-3H3,(H2,27,33)(H,28,30)
InChIKey FUPIBYPZVVNRAJ-UHFFFAOYSA-N
Mol Weight 505.59 g/mol
Molecular Formula C26H27N5O4S
Exact Mass 505.178376 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID L4eMAzw4Gj4
Name 4-{[4-(3-{[(2-hydroxy-1,1-dimethylethyl)amino]sulfonyl}-4-methylphenyl)-1-phthalazinyl]amino}benzamide
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/C26H27N5O4S/c1-16-8-9-18(14-22(16)36(34,35)31-26(2,3)15-32)23-20-6-4-5-7-21(20)25(30-29-23)28-19-12-10-17(11-13-19)24(27)33/h4-14,31-32H,15H2,1-3H3,(H2,27,33)(H,28,30)
InChIKey FUPIBYPZVVNRAJ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14978
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: C26507; Labnumber: RRAZ1-2383; SBI_ID: SBI-014981
Temperature 313 °C