(1S,4R,7S)-2-(4-methoxyphenyl)-7-((S)-(4-(trifluoromethyl)-phenyl)sulfinyl)bicyclo[2.2.1]hept-2-ene

SpectraBase Compound ID	9axkDg9FmE5
InChI	InChI=1S/C21H19F3O2S/c1-26-16-7-2-13(3-8-16)19-12-14-4-11-18(19)20(14)27(25)17-9-5-15(6-10-17)21(22,23)24/h2-3,5-10,12,14,18,20H,4,11H2,1H3/t14-,18+,20+,27?/m1/s1
InChIKey	DSSJOFDPQOJRTE-RHBRIXKOSA-N Google Search
Mol Weight	392.44 g/mol
Molecular Formula	C21H19F3O2S
Exact Mass	392.105786 g/mol

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SpectraBase Spectrum ID	23jK2P5U8ld
Name	(1S,4R,7S)-2-(4-methoxyphenyl)-7-((S)-(4-(trifluoromethyl)-phenyl)sulfinyl)bicyclo[2.2.1]hept-2-ene
Alternate Name(s)	(1S,4R,7S)-2-(4-methoxyphenyl)-7-((S)-(4-(trifluoromethyl)phenyl)sulfinyl)bicyclo[2.2.1]hept-2-ene
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H19F3O2S
InChI	InChI=1S/C21H19F3O2S/c1-26-16-7-2-13(3-8-16)19-12-14-4-11-18(19)20(14)27(25)17-9-5-15(6-10-17)21(22,23)24/h2-3,5-10,12,14,18,20H,4,11H2,1H3/t14-,18+,20+,27?/m1/s1
InChIKey	DSSJOFDPQOJRTE-RHBRIXKOSA-N
Literature Reference DOI	10.1021/ol200841x
Molecular Weight	392.436 g/mol
SMILES	[C@]1([C@]2(C=C(c3ccc(OC)cc3)[C@]1([H])CC2)[H])([S@@](c1ccc(cc1)C(F)(F)F)=O)[H]
SPLASH	splash10-00di-0901000000-fc02d0ddf1bf173982ae
Source of Spectrum	A1-13-3182/SMS16-15b
Wiley ID	1753180