3-[(6-oxo-4-phenyl-1,6-dihydro-2-pyrimidinyl)sulfanyl]propanoic acid

SpectraBase Compound ID	Az5teIvJd4V
InChI	InChI=1S/C13H12N2O3S/c16-11-8-10(9-4-2-1-3-5-9)14-13(15-11)19-7-6-12(17)18/h1-5,8H,6-7H2,(H,17,18)(H,14,15,16)
InChIKey	GEGGVBMHGZHCAE-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	1582grIAdN9
Name	3-[(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/c16-11-8-10(9-4-2-1-3-5-9)14-13(15-11)19-7-6-12(17)18/h1-5,8H,6-7H2,(H,17,18)(H,14,15,16)
InChIKey	GEGGVBMHGZHCAE-UHFFFAOYSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_13371
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: UZI/9122146; UBI_ID: UBI-013374
Temperature	308 °C