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N-methyl-2-{4-[(4-{4-methyl-3-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}-1-phthalazinyl)amino]phenoxy}acetamide
SpectraBase Compound ID LSmpAbOnmHC
InChI InChI=1S/C29H32N6O4S/c1-20-8-9-21(18-26(20)40(37,38)35-16-14-34(3)15-17-35)28-24-6-4-5-7-25(24)29(33-32-28)31-22-10-12-23(13-11-22)39-19-27(36)30-2/h4-13,18H,14-17,19H2,1-3H3,(H,30,36)(H,31,33)
InChIKey XECONXBBCNRJOR-UHFFFAOYSA-N
Mol Weight 560.7 g/mol
Molecular Formula C29H32N6O4S
Exact Mass 560.220575 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FV1uWp7tBMv
Name N-methyl-2-{4-[(4-{4-methyl-3-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}-1-phthalazinyl)amino]phenoxy}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/C29H32N6O4S/c1-20-8-9-21(18-26(20)40(37,38)35-16-14-34(3)15-17-35)28-24-6-4-5-7-25(24)29(33-32-28)31-22-10-12-23(13-11-22)39-19-27(36)30-2/h4-13,18H,14-17,19H2,1-3H3,(H,30,36)(H,31,33)
InChIKey XECONXBBCNRJOR-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14945
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: C26464; Labnumber: RRAZ1-2321; SBI_ID: SBI-014948
Temperature 313 °C