(5E)-1-hexyl-5-[(1-propyl-1H-indol-3-yl)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione

SpectraBase Compound ID	KQe4ZOe40mg
InChI	InChI=1S/C22H27N3O3/c1-3-5-6-9-13-25-21(27)18(20(26)23-22(25)28)14-16-15-24(12-4-2)19-11-8-7-10-17(16)19/h7-8,10-11,14-15H,3-6,9,12-13H2,1-2H3,(H,23,26,28)/b18-14+
InChIKey	NIWIKERCUWMBDR-NBVRZTHBSA-N Google Search
Mol Weight	381.48 g/mol
Molecular Formula	C22H27N3O3
Exact Mass	381.205242 g/mol

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SpectraBase Spectrum ID	HNDyfl4ftBw
Name	(5E)-1-hexyl-5-[(1-propyl-1H-indol-3-yl)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/C22H27N3O3/c1-3-5-6-9-13-25-21(27)18(20(26)23-22(25)28)14-16-15-24(12-4-2)19-11-8-7-10-17(16)19/h7-8,10-11,14-15H,3-6,9,12-13H2,1-2H3,(H,23,26,28)/b18-14+
InChIKey	NIWIKERCUWMBDR-NBVRZTHBSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_4760
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: E10377; Labnumber: KKA-0212B-0305; SBI_ID: SBI-004762
Synonyms	1-hexyl-5-[(1-propyl-1H-indol-3-yl)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature	318 °C