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6-iodo-2-{[1-methyl-2-(4-morpholinyl)-2-oxoethyl]sulfanyl}-3-phenyl-4(3H)-quinazolinone
SpectraBase Compound ID EH5NHs75RUT
InChI InChI=1S/C21H20IN3O3S/c1-14(19(26)24-9-11-28-12-10-24)29-21-23-18-8-7-15(22)13-17(18)20(27)25(21)16-5-3-2-4-6-16/h2-8,13-14H,9-12H2,1H3
InChIKey TUYUTAQPNLLDFO-UHFFFAOYSA-N
Mol Weight 521.37 g/mol
Molecular Formula C21H20IN3O3S
Exact Mass 521.027008 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BBnf2NrXaz2
Name 6-iodo-2-{[1-methyl-2-(4-morpholinyl)-2-oxoethyl]sulfanyl}-3-phenyl-4(3H)-quinazolinone
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/C21H20IN3O3S/c1-14(19(26)24-9-11-28-12-10-24)29-21-23-18-8-7-15(22)13-17(18)20(27)25(21)16-5-3-2-4-6-16/h2-8,13-14H,9-12H2,1H3
InChIKey TUYUTAQPNLLDFO-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_21293
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: D52210; Labnumber: AENIC71-0380; SBI_ID: SBI-021297
Temperature 318 °C