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acetic acid, [4-[[(4-[3-[(dimethylamino)sulfonyl]-4-methylphenyl]-1-oxo-2(1H)-phthalazinyl)acetyl]amino]phenoxy]-, methyl ester

View entire compound with spectra: 1 NMR

acetic acid, [4-[[(4-[3-[(dimethylamino)sulfonyl]-4-methylphenyl]-1-oxo-2(1H)-phthalazinyl)acetyl]amino]phenoxy]-, methyl ester
SpectraBase Compound ID 8oGsd77QXjJ
InChI InChI=1S/C28H28N4O7S/c1-18-9-10-19(15-24(18)40(36,37)31(2)3)27-22-7-5-6-8-23(22)28(35)32(30-27)16-25(33)29-20-11-13-21(14-12-20)39-17-26(34)38-4/h5-15H,16-17H2,1-4H3,(H,29,33)
InChIKey SGMJIZYRHACURM-UHFFFAOYSA-N
Mol Weight 564.61 g/mol
Molecular Formula C28H28N4O7S
Exact Mass 564.16787 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8ZC5xjzZRe0
Name acetic acid, [4-[[(4-[3-[(dimethylamino)sulfonyl]-4-methylphenyl]-1-oxo-2(1H)-phthalazinyl)acetyl]amino]phenoxy]-, methyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 564.167870425 u
Formula C28H28N4O7S
InChI InChI=1S/C28H28N4O7S/c1-18-9-10-19(15-24(18)40(36,37)31(2)3)27-22-7-5-6-8-23(22)28(35)32(30-27)16-25(33)29-20-11-13-21(14-12-20)39-17-26(34)38-4/h5-15H,16-17H2,1-4H3,(H,29,33)
InChIKey SGMJIZYRHACURM-UHFFFAOYSA-N
Molecular Weight 564.613 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16536
Solvent DMSO-d6
Source Vendor ID: NMR/10310103; Lab Info: ZUB; Lab Number: ZUB-0000815