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1-(3-chloro-4-methylphenyl)-3-[(4,6,7-trimethyl-2-quinazolinyl)sulfanyl]-2,5-pyrrolidinedione
SpectraBase Compound ID Kkjzg3oGEUi
InChI InChI=1S/C22H20ClN3O2S/c1-11-5-6-15(9-17(11)23)26-20(27)10-19(21(26)28)29-22-24-14(4)16-7-12(2)13(3)8-18(16)25-22/h5-9,19H,10H2,1-4H3
InChIKey XWBGROKLMHOACZ-UHFFFAOYSA-N
Mol Weight 425.93 g/mol
Molecular Formula C22H20ClN3O2S
Exact Mass 425.096476 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5UJraX0NzTG
Name 1-(3-chloro-4-methylphenyl)-3-[(4,6,7-trimethyl-2-quinazolinyl)sulfanyl]-2,5-pyrrolidinedione
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/C22H20ClN3O2S/c1-11-5-6-15(9-17(11)23)26-20(27)10-19(21(26)28)29-22-24-14(4)16-7-12(2)13(3)8-18(16)25-22/h5-9,19H,10H2,1-4H3
InChIKey XWBGROKLMHOACZ-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_17468
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: D27263; Labnumber: VGU-18454; SBI_ID: SBI-017471
Temperature 315 °C