ethanaminium, 2-[(1-benzoyl-1,6-dihydro-4-hydroxy-6-oxo-5-propyl-2-pyrimidinyl)thio]-N,N-diethyl-, chloride

SpectraBase Compound ID	4IbMytlxNdn
InChI	InChI=1S/C20H27N3O3S.ClH/c1-4-10-16-17(24)21-20(27-14-13-22(5-2)6-3)23(19(16)26)18(25)15-11-8-7-9-12-15;/h7-9,11-12,24H,4-6,10,13-14H2,1-3H3;1H
InChIKey	ZEQBIFRRQHJXBR-UHFFFAOYSA-N Google Search
Mol Weight	425.98 g/mol
Molecular Formula	C20H28ClN3O3S
Exact Mass	425.153991 g/mol

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SpectraBase Spectrum ID	9MiE2ai0FMn
Name	ethanaminium, 2-[(1-benzoyl-1,6-dihydro-4-hydroxy-6-oxo-5-propyl-2-pyrimidinyl)thio]-N,N-diethyl-, chloride
Copyright	Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	425.153990645 u
Formula	C20H28ClN3O3S
InChI	InChI=1S/C20H27N3O3S.ClH/c1-4-10-16-17(24)21-20(27-14-13-22(5-2)6-3)23(19(16)26)18(25)15-11-8-7-9-12-15;/h7-9,11-12,24H,4-6,10,13-14H2,1-3H3;1H
InChIKey	ZEQBIFRRQHJXBR-UHFFFAOYSA-N
Molecular Weight	425.975 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_12821
Solvent	DMSO-d6
Source	Vendor ID: ZI/10023532; Lab Info: PLU; Lab Number: FCI-427-0022