For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
N-(4-{[4-(3-{[(2-hydroxy-1,1-dimethylethyl)amino]sulfonyl}-4-methylphenyl)-1-phthalazinyl]amino}phenyl)acetamide
SpectraBase Compound ID 9WYxWqYBirR
InChI InChI=1S/C27H29N5O4S/c1-17-9-10-19(15-24(17)37(35,36)32-27(3,4)16-33)25-22-7-5-6-8-23(22)26(31-30-25)29-21-13-11-20(12-14-21)28-18(2)34/h5-15,32-33H,16H2,1-4H3,(H,28,34)(H,29,31)
InChIKey MFKNLDHTNGKMCK-UHFFFAOYSA-N
Mol Weight 519.62 g/mol
Molecular Formula C27H29N5O4S
Exact Mass 519.194026 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID JPCyXXq0RNj
Name N-(4-{[4-(3-{[(2-hydroxy-1,1-dimethylethyl)amino]sulfonyl}-4-methylphenyl)-1-phthalazinyl]amino}phenyl)acetamide
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/C27H29N5O4S/c1-17-9-10-19(15-24(17)37(35,36)32-27(3,4)16-33)25-22-7-5-6-8-23(22)26(31-30-25)29-21-13-11-20(12-14-21)28-18(2)34/h5-15,32-33H,16H2,1-4H3,(H,28,34)(H,29,31)
InChIKey MFKNLDHTNGKMCK-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14948
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: C26467; Labnumber: RRAZ1-2336; SBI_ID: SBI-014951
Temperature 313 °C