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4(3H)-quinazolinone, 2-[[(5-acetyl-2-methoxyphenyl)methyl]thio]-3-(1,3-benzodioxol-5-yl)-
SpectraBase Compound ID 900wfxkfxG
InChI InChI=1S/C25H20N2O5S/c1-15(28)16-7-9-21(30-2)17(11-16)13-33-25-26-20-6-4-3-5-19(20)24(29)27(25)18-8-10-22-23(12-18)32-14-31-22/h3-12H,13-14H2,1-2H3
InChIKey XJGPIMIWTMEZMX-UHFFFAOYSA-N
Mol Weight 460.5 g/mol
Molecular Formula C25H20N2O5S
Exact Mass 460.109293 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2WMcAGJY2ob
Name 4(3H)-quinazolinone, 2-[[(5-acetyl-2-methoxyphenyl)methyl]thio]-3-(1,3-benzodioxol-5-yl)-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C25H20N2O5S/c1-15(28)16-7-9-21(30-2)17(11-16)13-33-25-26-20-6-4-3-5-19(20)24(29)27(25)18-8-10-22-23(12-18)32-14-31-22/h3-12H,13-14H2,1-2H3
InChIKey XJGPIMIWTMEZMX-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_383
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: NMR/10328013