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1,2-Dideoxy-3,4:6,7-di-O-isopropylidene-1.alpha.-(methylsulfanyl)-2-C-(trifluoromethyl)-D-glycero-D-galacto-heptopyranoside

View entire compound with spectra: 1 MS (GC)

1,2-Dideoxy-3,4:6,7-di-O-isopropylidene-1.alpha.-(methylsulfanyl)-2-C-(trifluoromethyl)-D-glycero-D-galacto-heptopyranoside
SpectraBase Compound ID 1HbyDM2PDNJ
InChI InChI=1S/C15H23F3O5S/c1-13(2)19-6-7(21-13)9-11-10(22-14(3,4)23-11)8(15(16,17)18)12(20-9)24-5/h7-12H,6H2,1-5H3/t7-,8+,9?,10?,11+,12?/m1/s1
InChIKey KISRDEDOYKUIQG-DSFXUTHPSA-N
Mol Weight 372.4 g/mol
Molecular Formula C15H23F3O5S
Exact Mass 372.121829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1sqoggp3MEq
Name 1,2-Dideoxy-3,4:6,7-di-O-isopropylidene-1.alpha.-(methylsulfanyl)-2-C-(trifluoromethyl)-D-glycero-D-galacto-heptopyranoside
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H23F3O5S
InChI InChI=1S/C15H23F3O5S/c1-13(2)19-6-7(21-13)9-11-10(22-14(3,4)23-11)8(15(16,17)18)12(20-9)24-5/h7-12H,6H2,1-5H3/t7-,8+,9?,10?,11+,12?/m1/s1
InChIKey KISRDEDOYKUIQG-DSFXUTHPSA-N
Molecular Weight 372.399 g/mol
SMILES [C@@]12(C([C@](C(F)(F)F)(C(OC2[C@@]2(OC(C)(C)OC2)[H])SC)[H])OC(O1)(C)C)[H]
SPLASH splash10-066r-0693000000-716922f965dbcac55155
Source of Spectrum J-62-9112-13
Synonyms (4R)-4-[(3aR,7R)-2,2-dimethyl-6-(methylsulfanyl)-7-(trifluoromethyl)-hexahydro-[1,3]dioxolo[4,5-c]pyran-4-yl]-2,2-dimethyl-1,3-dioxolane
Wiley ID 1355235