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(S)-3,3'-Bis(4-(trifluoromethyl)phenyl)-5,5',6,6',7,7',8,8'-octahydro-1,1'-binaphthyl-2,2'-diol
SpectraBase Compound ID BTKKVW1FZWN
InChI InChI=1S/C34H28F6O2/c35-33(36,37)23-13-9-19(10-14-23)27-17-21-5-1-3-7-25(21)29(31(27)41)30-26-8-4-2-6-22(26)18-28(32(30)42)20-11-15-24(16-12-20)34(38,39)40/h9-18,41-42H,1-8H2
InChIKey AUIQPOBKXFVFEH-UHFFFAOYSA-N
Mol Weight 582.6 g/mol
Molecular Formula C34H28F6O2
Exact Mass 582.199349 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cl9NOWASzUv
Name (S)-3,3'-Bis(4-(trifluoromethyl)phenyl)-5,5',6,6',7,7',8,8'-octahydro-1,1'-binaphthyl-2,2'-diol
Alternate Name(s) 3,3'-bis(4-(trifluoromethyl)phenyl)-5,5',6,6',7,7',8,8'-octahydro-[1,1'-binaphthalene]-2,2'-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H28F6O2
InChI InChI=1S/C34H28F6O2/c35-33(36,37)23-13-9-19(10-14-23)27-17-21-5-1-3-7-25(21)29(31(27)41)30-26-8-4-2-6-22(26)18-28(32(30)42)20-11-15-24(16-12-20)34(38,39)40/h9-18,41-42H,1-8H2
InChIKey AUIQPOBKXFVFEH-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cctc.200900263
Molecular Weight 582.586 g/mol
SMILES Oc1c(cc2c(c1-c1c3c(cc(c1O)-c1ccc(cc1)C(F)(F)F)CCCC3)CCCC2)-c1ccc(cc1)C(F)(F)F
SPLASH splash10-001i-2010090000-e2187945cab6c131e784
Source of Spectrum CCC-2-456-4f
Wiley ID 1786873