3-thiazolehexanol, 4-(4-ethylphenyl)-2,3-dihydro-2-[[3-(trifluoromethyl)phenyl]imino]-, monohydrobromide

SpectraBase Compound ID	HUutSGzflhy
InChI	InChI=1S/C24H27F3N2OS.BrH/c1-2-18-10-12-19(13-11-18)22-17-31-23(29(22)14-5-3-4-6-15-30)28-21-9-7-8-20(16-21)24(25,26)27;/h7-13,16-17,30H,2-6,14-15H2,1H3;1H/b28-23-;
InChIKey	DKBJZOZEARIGQA-MCOPDZHSSA-N Google Search
Mol Weight	529.46 g/mol
Molecular Formula	C24H28BrF3N2OS
Exact Mass	528.105782 g/mol

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SpectraBase Spectrum ID	2J2gCTpXZm5
Name	3-thiazolehexanol, 4-(4-ethylphenyl)-2,3-dihydro-2-[[3-(trifluoromethyl)phenyl]imino]-, monohydrobromide
Copyright	Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	528.105782192 u
Formula	C24H28BrF3N2OS
InChI	InChI=1S/C24H27F3N2OS.BrH/c1-2-18-10-12-19(13-11-18)22-17-31-23(29(22)14-5-3-4-6-15-30)28-21-9-7-8-20(16-21)24(25,26)27;/h7-13,16-17,30H,2-6,14-15H2,1H3;1H/b28-23-;
InChIKey	DKBJZOZEARIGQA-MCOPDZHSSA-N
Molecular Weight	529.460 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_905
Solvent	DMSO-d6
Source	Vendor ID: ZI/7108106; Lab Info: PE; Lab Number: PE-0003987