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(2R,3R)-2-(2",4"-Bis[trifluoroethoxy]-5"-hydroxybenzyl)-3-(3',4'-dimethoxybenzyl)butyrolactone
SpectraBase Compound ID LnkAlO7keaf
InChI InChI=1S/C24H24F6O7/c1-33-18-4-3-13(6-21(18)34-2)5-15-10-35-22(32)16(15)7-14-8-17(31)20(37-12-24(28,29)30)9-19(14)36-11-23(25,26)27/h3-4,6,8-9,15-16,31H,5,7,10-12H2,1-2H3/t15-,16+/m0/s1
InChIKey CGRGLDPSNRBJDX-JKSUJKDBSA-N
Mol Weight 538.44 g/mol
Molecular Formula C24H24F6O7
Exact Mass 538.142622 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4I6eD6VWAgJ
Name (2R,3R)-2-(2",4"-Bis[trifluoroethoxy]-5"-hydroxybenzyl)-3-(3',4'-dimethoxybenzyl)butyrolactone
Alternate Name(s) (2R,3R)-2-(2'',4''-Bis[trifluoroethoxy]-5''-hydroxybenzyl)-3-(3',4'-dimethoxybenzyl)butyrolactone (3R,4R)-4-(3,4-dimethoxybenzyl)-3-[5-hydroxy-2,4-bis(2,2,2-trifluoroethoxy)benzyl]dihydro-2(3H)-furanone trans-2-(2'',4''-Bis[trifluoroethoxy]-5''-hydroxybenzyl)-3-(3',4'-dimethoxybenzyl)butyrolactone trans-2-(2'',4''-Bis[trifluoroethoxy]-5''-hydroxybenzyl)-3-(3',4'-dimethoxybenzyl)butyrolactone
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Formula C24H24F6O7
InChI InChI=1S/C24H24F6O7/c1-33-18-4-3-13(6-21(18)34-2)5-15-10-35-22(32)16(15)7-14-8-17(31)20(37-12-24(28,29)30)9-19(14)36-11-23(25,26)27/h3-4,6,8-9,15-16,31H,5,7,10-12H2,1-2H3/t15-,16+/m0/s1
InChIKey CGRGLDPSNRBJDX-JKSUJKDBSA-N
Molecular Weight 538.439 g/mol
SMILES Oc1c(OCC(F)(F)F)cc(c(C[C@]2(C(OC[C@@]2(Cc2cc(OC)c(cc2)OC)[H])=O)[H])c1)OCC(F)(F)F
SPLASH splash10-0udr-0900050000-33979fea4ccedaefe7aa
Source of Spectrum F-52-1333-46
Wiley ID 794852