(5E)-1-(2-furylmethyl)-5-[(hexahydro-1H-azepin-1-ylamino)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione

SpectraBase Compound ID	G0uiZYK2gwM
InChI	InChI=1S/C16H20N4O4/c21-14-13(10-17-19-7-3-1-2-4-8-19)15(22)20(16(23)18-14)11-12-6-5-9-24-12/h5-6,9-10,17H,1-4,7-8,11H2,(H,18,21,23)/b13-10+
InChIKey	UDMWEEXJFYRUKP-JLHYYAGUSA-N Google Search
Mol Weight	332.36 g/mol
Molecular Formula	C16H20N4O4
Exact Mass	332.148455 g/mol

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SpectraBase Spectrum ID	G3J4vWoBUbB
Name	(5E)-1-(2-furylmethyl)-5-[(hexahydro-1H-azepin-1-ylamino)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione
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/C16H20N4O4/c21-14-13(10-17-19-7-3-1-2-4-8-19)15(22)20(16(23)18-14)11-12-6-5-9-24-12/h5-6,9-10,17H,1-4,7-8,11H2,(H,18,21,23)/b13-10+
InChIKey	UDMWEEXJFYRUKP-JLHYYAGUSA-N
NMR Offset	18.0059
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_8990
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: D40144; Labnumber: KKA-0211-2088; SBI_ID: SBI-008993
Synonyms	1-(2-furylmethyl)-5-[(hexahydro-1H-azepin-1-ylamino)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature	306 °C