2-Azabicyclo[2.2.1]heptane-3-bis[p-(trifluoromethyl)phenyl]methanol

SpectraBase Compound ID	DBaDXwJVIPZ
InChI	InChI=1S/C21H19F6NO/c22-20(23,24)15-6-2-13(3-7-15)19(29,18-12-1-10-17(11-12)28-18)14-4-8-16(9-5-14)21(25,26)27/h2-9,12,17-18,28-29H,1,10-11H2/t12-,17+,18+/m0/s1
InChIKey	BCKNKZHTPPVLCK-JBBXEZCESA-N Google Search
Mol Weight	415.38 g/mol
Molecular Formula	C21H19F6NO
Exact Mass	415.137083 g/mol

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SpectraBase Spectrum ID	C1tODxijeUi
Name	2-Azabicyclo[2.2.1]heptane-3-bis[p-(trifluoromethyl)phenyl]methanol
Alternate Name(s)	(1S,3R,4R)-2-Azabicyclo[2.2.1]heptane-3-bis[p-(trifluoromethyl)phenyl]methanol 2-Azabicyclo[2.2.1]hept-3-yl{bis[4-(trifluoromethyl)phenyl]}methanol
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H19F6NO
InChI	InChI=1S/C21H19F6NO/c22-20(23,24)15-6-2-13(3-7-15)19(29,18-12-1-10-17(11-12)28-18)14-4-8-16(9-5-14)21(25,26)27/h2-9,12,17-18,28-29H,1,10-11H2/t12-,17+,18+/m0/s1
InChIKey	BCKNKZHTPPVLCK-JBBXEZCESA-N
Molecular Weight	415.379 g/mol
SMILES	OC([C@@]1(N[C@]2(C[C@@]1(CC2)[H])[H])[H])(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1
SPLASH	splash10-00kb-9200000000-564f8256c9ecc9a93291
Source of Spectrum	F-54-7904-1
Wiley ID	807647