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(3R,5R)-5-(tert-Butyldimethylsilyloxymethyl)-3-trifluoromethyltetrahydrothiophen-2-yl acetate
SpectraBase Compound ID 9ZNt6udSAka
InChI InChI=1S/C14H25F3O3SSi/c1-9(18)20-12-11(14(15,16)17)7-10(21-12)8-19-22(5,6)13(2,3)4/h10-12H,7-8H2,1-6H3/t10-,11+,12?/m1/s1
InChIKey PNTGKQBEJBFFJK-UBNQGINQSA-N
Mol Weight 358.49 g/mol
Molecular Formula C14H25F3O3SSi
Exact Mass 358.124577 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CeJIdx7gO8A
Name (3R,5R)-5-(tert-Butyldimethylsilyloxymethyl)-3-trifluoromethyltetrahydrothiophen-2-yl acetate
Comments Less than 3 mono-isotopic peaks
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Formula C14H25F3O3SSi
InChI InChI=1S/C14H25F3O3SSi/c1-9(18)20-12-11(14(15,16)17)7-10(21-12)8-19-22(5,6)13(2,3)4/h10-12H,7-8H2,1-6H3/t10-,11+,12?/m1/s1
InChIKey PNTGKQBEJBFFJK-UBNQGINQSA-N
Molecular Weight 358.491 g/mol
SMILES C(C)(=O)OC1[C@](C[C@@](S1)(CO[Si](C)(C)C(C)(C)C)[H])(C(F)(F)F)[H]
SPLASH splash10-0006-9000000000-bbf0b36f7be944d3e4f8
Source of Spectrum J-67-1019-8
Synonyms 1-O-acetyl-5-O-[tert-butyl(dimethyl)silyl]-2,3-dideoxy-4-thio-2-(trifluoromethyl)-L-erythro-pentofuranose acetic acid[(3R,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-(trifluoromethyl)-2-thiolanyl]ester acetic acid[(3R,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-(trifluoromethyl)tetrahydrothiophen-2-yl]ester [(3R,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-(trifluoromethyl)thiolan-2-yl]acetate [(3R,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-(trifluoromethyl)thiolan-2-yl]ethanoate acetic acid [(3R,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-(trifluoromethyl)-2-thiolanyl] ester [(3R,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-(trifluoromethyl)thiolan-2-yl] acetate [(3R,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-(trifluoromethyl)tetrahydrothiophen-2-yl] acetate [(3R,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-3-(trifluoromethyl)thiolan-2-yl] ethanoate
Wiley ID 1569144