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Methyl 9-phenyl-1-methyl-3-trifluoromethansulfonyloxy-9,10-dihydro-phenanthrene-4-carboxylate
SpectraBase Compound ID 3p20LRf7cMO
InChI InChI=1S/C24H19F3O5S/c1-14-12-20(32-33(29,30)24(25,26)27)22(23(28)31-2)21-17-11-7-6-10-16(17)19(13-18(14)21)15-8-4-3-5-9-15/h3-12,19H,13H2,1-2H3
InChIKey CAKUHXDQKOWMGC-UHFFFAOYSA-N
Mol Weight 476.47 g/mol
Molecular Formula C24H19F3O5S
Exact Mass 476.090529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BYUPXxQJIEn
Name Methyl 9-phenyl-1-methyl-3-trifluoromethansulfonyloxy-9,10-dihydro-phenanthrene-4-carboxylate
Alternate Name(s) 1-Methyl-9-phenyl-3-(trifluoromethylsulfonyloxy)-9,10-dihydrophenanthrene-4-carboxylic acid methyl ester Methyl 1-methyl-9-phenyl-3-(trifluoromethylsulfonyloxy)-9,10-dihydrophenanthrene-4-carboxylate
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Formula C24H19F3O5S
InChI InChI=1S/C24H19F3O5S/c1-14-12-20(32-33(29,30)24(25,26)27)22(23(28)31-2)21-17-11-7-6-10-16(17)19(13-18(14)21)15-8-4-3-5-9-15/h3-12,19H,13H2,1-2H3
InChIKey CAKUHXDQKOWMGC-UHFFFAOYSA-N
Molecular Weight 476.466 g/mol
SMILES C(S(Oc1c(c2-c3c(cccc3)C(Cc2c(c1)C)c1ccccc1)C(=O)OC)(=O)=O)(F)(F)F
SPLASH splash10-01u0-0055900000-fba2d11580f3af4885f5
Source of Spectrum U1-2010-5125-7
Wiley ID 1664398