(2E)-[(5-amino-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-4-pyrimidinyl)imino](1H-benzimidazol-2-yl)ethanenitrile

SpectraBase Compound ID	FJ2GxvfJNlJ
InChI	InChI=1S/C15H13N7O2/c1-21-13(11(17)14(23)22(2)15(21)24)20-10(7-16)12-18-8-5-3-4-6-9(8)19-12/h3-6H,17H2,1-2H3,(H,18,19)/b20-10+
InChIKey	HOWOVXOHXQTYCA-KEBDBYFISA-N Google Search
Mol Weight	323.32 g/mol
Molecular Formula	C15H13N7O2
Exact Mass	323.113073 g/mol

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SpectraBase Spectrum ID	88u7PKG3TqK
Name	(2E)-[(5-amino-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-4-pyrimidinyl)imino](1H-benzimidazol-2-yl)ethanenitrile
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/C15H13N7O2/c1-21-13(11(17)14(23)22(2)15(21)24)20-10(7-16)12-18-8-5-3-4-6-9(8)19-12/h3-6H,17H2,1-2H3,(H,18,19)/b20-10+
InChIKey	HOWOVXOHXQTYCA-KEBDBYFISA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_9791
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: 128525; Labnumber: EX00112513; VK_ID: VK-009795
Synonyms	[(5-amino-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-4-pyrimidinyl)imino](1H-benzimidazol-2-yl)ethanenitrile
Temperature	315 °C