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4-[(2,1,3-benzothiadiazol-4-ylsulfonyl)acetyl]-1-(2-phenylethyl)-2,6-piperazinedione
SpectraBase Compound ID DWSd3iw5wSG
InChI InChI=1S/C20H18N4O5S2/c25-17-11-23(12-18(26)24(17)10-9-14-5-2-1-3-6-14)19(27)13-31(28,29)16-8-4-7-15-20(16)22-30-21-15/h1-8H,9-13H2
InChIKey BANCYQIHTLGHLP-UHFFFAOYSA-N
Mol Weight 458.51 g/mol
Molecular Formula C20H18N4O5S2
Exact Mass 458.071862 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GLoHIt8GjYk
Name 4-[(2,1,3-benzothiadiazol-4-ylsulfonyl)acetyl]-1-(2-phenylethyl)-2,6-piperazinedione
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 458.071862039 u
Formula C20H18N4O5S2
InChI InChI=1S/C20H18N4O5S2/c25-17-11-23(12-18(26)24(17)10-9-14-5-2-1-3-6-14)19(27)13-31(28,29)16-8-4-7-15-20(16)22-30-21-15/h1-8H,9-13H2
InChIKey BANCYQIHTLGHLP-UHFFFAOYSA-N
Molecular Weight 458.507 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_4506
Solvent DMSO-d6
Source Vendor ID: NMR/12309476