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2,4(1H,3H)-quinazolinedione, 1,3-dimethyl-6-[[2-[(4-phenyl-1-piperazinyl)carbonyl]-1-pyrrolidinyl]sulfonyl]-
SpectraBase Compound ID 8zvggFiypP5
InChI InChI=1S/C25H29N5O5S/c1-26-21-11-10-19(17-20(21)23(31)27(2)25(26)33)36(34,35)30-12-6-9-22(30)24(32)29-15-13-28(14-16-29)18-7-4-3-5-8-18/h3-5,7-8,10-11,17,22H,6,9,12-16H2,1-2H3
InChIKey NYSUYPWUJUPWJH-UHFFFAOYSA-N
Mol Weight 511.6 g/mol
Molecular Formula C25H29N5O5S
Exact Mass 511.18894 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID L2o9qkdPZz9
Name 2,4(1H,3H)-quinazolinedione, 1,3-dimethyl-6-[[2-[(4-phenyl-1-piperazinyl)carbonyl]-1-pyrrolidinyl]sulfonyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 511.188940223 u
Formula C25H29N5O5S
InChI InChI=1S/C25H29N5O5S/c1-26-21-11-10-19(17-20(21)23(31)27(2)25(26)33)36(34,35)30-12-6-9-22(30)24(32)29-15-13-28(14-16-29)18-7-4-3-5-8-18/h3-5,7-8,10-11,17,22H,6,9,12-16H2,1-2H3
InChIKey NYSUYPWUJUPWJH-UHFFFAOYSA-N
Molecular Weight 511.597 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_3998
Solvent DMSO-d6
Source Vendor ID: NMR/13279443