2-[(4,6-diamino-2-pyrimidinyl)sulfanyl]propanoic acid

SpectraBase Compound ID	LXvrOe6mkvI
InChI	InChI=1S/C7H10N4O2S/c1-3(6(12)13)14-7-10-4(8)2-5(9)11-7/h2-3H,1H3,(H,12,13)(H4,8,9,10,11)
InChIKey	VMMSKDJWIWBHJL-UHFFFAOYSA-N Google Search
Mol Weight	214.24 g/mol
Molecular Formula	C7H10N4O2S
Exact Mass	214.052447 g/mol

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SpectraBase Spectrum ID	8IiqlnGcwU9
Name	2-[(4,6-diamino-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/C7H10N4O2S/c1-3(6(12)13)14-7-10-4(8)2-5(9)11-7/h2-3H,1H3,(H,12,13)(H4,8,9,10,11)
InChIKey	VMMSKDJWIWBHJL-UHFFFAOYSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_3531
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: 9314689; UBI_ID: UBI-003532
Temperature	308 °C