3-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]propionic acid

SpectraBase Compound ID	D46m1hVUIjD
InChI	InChI=1S/C7H9N3O3S/c8-4-3-5(11)10-7(9-4)14-2-1-6(12)13/h3H,1-2H2,(H,12,13)(H3,8,9,10,11)
InChIKey	AVUZNCBNWOIPHH-UHFFFAOYSA-N Google Search
Mol Weight	215.23 g/mol
Molecular Formula	C7H9N3O3S
Exact Mass	215.036462 g/mol

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SpectraBase Spectrum ID	9eMD86ZaOK1
Name	3-[(4-amino-6-oxo-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/C7H9N3O3S/c8-4-3-5(11)10-7(9-4)14-2-1-6(12)13/h3H,1-2H2,(H,12,13)(H3,8,9,10,11)
InChIKey	AVUZNCBNWOIPHH-UHFFFAOYSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_3530
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: 9314387; UBI_ID: UBI-003531
Temperature	308 °C