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	8LflJxrdtoy
Name	propanoic acid, 3-[(4-amino-1,6-dihydro-6-oxo-2-pyrimidinyl)thio]-
Copyright	Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	215.036462333 u
Formula	C7H9N3O3S
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
Molecular Weight	215.227 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_10651
Solvent	DMSO-d6
Source	Vendor ID: NMR/10252311; Lab Info: LD; Lab Number: LD-P430029