1,1-bis[ 4'-(Dimethylamino)phenyl] [5'-ethynyl-3',4'-bis(trifluoromethyl)-2'-furyl ] methanol

SpectraBase Compound ID	6JAm525n09q
InChI	InChI=1S/C25H22F6N2O2/c1-6-19-20(24(26,27)28)21(25(29,30)31)22(35-19)23(34,15-7-11-17(12-8-15)32(2)3)16-9-13-18(14-10-16)33(4)5/h1,7-14,34H,2-5H3
InChIKey	NMGSOOSWISZMDY-UHFFFAOYSA-N Google Search
Mol Weight	496.45 g/mol
Molecular Formula	C25H22F6N2O2
Exact Mass	496.158547 g/mol

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SpectraBase Spectrum ID	8Uw3SVBLrMn
Name	1,1-bis[ 4'-(Dimethylamino)phenyl] [5'-ethynyl-3',4'-bis(trifluoromethyl)-2'-furyl ] methanol
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	496.158546932 u
Formula	C25H22F6N2O2
InChI	InChI=1S/C25H22F6N2O2/c1-6-19-20(24(26,27)28)21(25(29,30)31)22(35-19)23(34,15-7-11-17(12-8-15)32(2)3)16-9-13-18(14-10-16)33(4)5/h1,7-14,34H,2-5H3
InChIKey	NMGSOOSWISZMDY-UHFFFAOYSA-N
Molecular Weight	496.453 g/mol
SMILES	C=1(C(=C(C#C)OC1C(C=1C=CC(=CC1)N(C)C)(C1=CC=C(C=C1)N(C)C)O)C(F)(F)F)C(F)(F)F