5H-imidazo[2,1-b][1,3]thiazinium, 1-(2,5-dimethoxyphenyl)-3-(4-fluorophenyl)-2,3,6,7-tetrahydro-3-hydroxy-, bromide

SpectraBase Compound ID	4aDWaOkh2B5
InChI	InChI=1S/C20H22FN2O3S.BrH/c1-25-16-8-9-18(26-2)17(12-16)22-13-20(24,14-4-6-15(21)7-5-14)23-10-3-11-27-19(22)23;/h4-9,12,24H,3,10-11,13H2,1-2H3;1H/q+1;/p-1
InChIKey	NSDKSFUUTRUKEG-UHFFFAOYSA-M Google Search
Mol Weight	469.37 g/mol
Molecular Formula	C20H22BrFN2O3S
Exact Mass	468.051855 g/mol

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SpectraBase Spectrum ID	6WCV2lf9hBV
Name	5H-imidazo[2,1-b][1,3]thiazinium, 1-(2,5-dimethoxyphenyl)-3-(4-fluorophenyl)-2,3,6,7-tetrahydro-3-hydroxy-, bromide
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/C20H22FN2O3S.BrH/c1-25-16-8-9-18(26-2)17(12-16)22-13-20(24,14-4-6-15(21)7-5-14)23-10-3-11-27-19(22)23;/h4-9,12,24H,3,10-11,13H2,1-2H3;1H/q+1;/p-1
InChIKey	NSDKSFUUTRUKEG-UHFFFAOYSA-M
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB3_9000_5559
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: NMR/11278270