(5E)-1-cycloheptyl-5-{[(4-fluorobenzyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione

SpectraBase Compound ID	pTVN3jNtbg
InChI	InChI=1S/C19H22FN3O3/c20-14-9-7-13(8-10-14)11-21-12-16-17(24)22-19(26)23(18(16)25)15-5-3-1-2-4-6-15/h7-10,12,15,21H,1-6,11H2,(H,22,24,26)/b16-12+
InChIKey	JLUWCELTJZPRBB-FOWTUZBSSA-N Google Search
Mol Weight	359.4 g/mol
Molecular Formula	C19H22FN3O3
Exact Mass	359.16452 g/mol

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SpectraBase Spectrum ID	2LXAVkqwCkH
Name	(5E)-1-cycloheptyl-5-{[(4-fluorobenzyl)amino]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/C19H22FN3O3/c20-14-9-7-13(8-10-14)11-21-12-16-17(24)22-19(26)23(18(16)25)15-5-3-1-2-4-6-15/h7-10,12,15,21H,1-6,11H2,(H,22,24,26)/b16-12+
InChIKey	JLUWCELTJZPRBB-FOWTUZBSSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_10705
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: E02892; Labnumber: KKA-0211-3683; SBI_ID: SBI-010708
Synonyms	1-cycloheptyl-5-{[(4-fluorobenzyl)amino]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature	318 °C