benzoic acid, 4-[[[3,4-dihydro-4-oxo-3-(2-propenyl)-2-quinazolinyl]thio]methyl]-, methyl ester

SpectraBase Compound ID	8DDVBchnBCy
InChI	InChI=1S/C20H18N2O3S/c1-3-12-22-18(23)16-6-4-5-7-17(16)21-20(22)26-13-14-8-10-15(11-9-14)19(24)25-2/h3-11H,1,12-13H2,2H3
InChIKey	PEPKSAPFSJMXLU-UHFFFAOYSA-N Google Search
Mol Weight	366.44 g/mol
Molecular Formula	C20H18N2O3S
Exact Mass	366.103814 g/mol

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SpectraBase Spectrum ID	CnbvFXp8gcC
Name	benzoic acid, 4-[[[3,4-dihydro-4-oxo-3-(2-propenyl)-2-quinazolinyl]thio]methyl]-, methyl ester
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/C20H18N2O3S/c1-3-12-22-18(23)16-6-4-5-7-17(16)21-20(22)26-13-14-8-10-15(11-9-14)19(24)25-2/h3-11H,1,12-13H2,2H3
InChIKey	PEPKSAPFSJMXLU-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_8313_7729
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/10329646