2-[(6-oxo-4-phenyl-1,6-dihydro-2-pyrimidinyl)sulfanyl]propanoic acid

SpectraBase Compound ID	53NrbZsuiZi
InChI	InChI=1S/C13H12N2O3S/c1-8(12(17)18)19-13-14-10(7-11(16)15-13)9-5-3-2-4-6-9/h2-8H,1H3,(H,17,18)(H,14,15,16)
InChIKey	MOIRVCXXIYVOEV-UHFFFAOYSA-N Google Search
Mol Weight	276.31 g/mol
Molecular Formula	C13H12N2O3S
Exact Mass	276.056863 g/mol

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SpectraBase Spectrum ID	J2PLqRnDljE
Name	2-[(6-oxo-4-phenyl-1,6-dihydro-2-pyrimidinyl)sulfanyl]propanoic acid
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/C13H12N2O3S/c1-8(12(17)18)19-13-14-10(7-11(16)15-13)9-5-3-2-4-6-9/h2-8H,1H3,(H,17,18)(H,14,15,16)
InChIKey	MOIRVCXXIYVOEV-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_5170
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: 9681199; UBI_ID: UBI-005172
Temperature	318 °C