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4-(3-{[4-(2-hydroxyethyl)-1-piperazinyl]sulfonyl}-4-methylphenyl)-1(2H)-phthalazinone
SpectraBase Compound ID ajFyKP1aOp
InChI InChI=1S/C21H24N4O4S/c1-15-6-7-16(20-17-4-2-3-5-18(17)21(27)23-22-20)14-19(15)30(28,29)25-10-8-24(9-11-25)12-13-26/h2-7,14,26H,8-13H2,1H3,(H,23,27)
InChIKey SCTGIRJMRGPNOR-UHFFFAOYSA-N
Mol Weight 428.51 g/mol
Molecular Formula C21H24N4O4S
Exact Mass 428.151826 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID B2CY8WMwoF5
Name 4-(3-{[4-(2-hydroxyethyl)-1-piperazinyl]sulfonyl}-4-methylphenyl)-1(2H)-phthalazinone
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/C21H24N4O4S/c1-15-6-7-16(20-17-4-2-3-5-18(17)21(27)23-22-20)14-19(15)30(28,29)25-10-8-24(9-11-25)12-13-26/h2-7,14,26H,8-13H2,1H3,(H,23,27)
InChIKey SCTGIRJMRGPNOR-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16011
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: D09549; Labnumber: RRAZ1-3439; SBI_ID: SBI-016014
Temperature 318 °C