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(2R,3R,4R,5R)-(-)-1,2:4,5-Di(isopropylidenedioxy)hept-6-en-3-yl p-toluenesulfonate
SpectraBase Compound ID 4U8RxuwLuGw
InChI InChI=1S/C20H28O7S/c1-7-15-17(26-20(5,6)24-15)18(16-12-23-19(3,4)25-16)27-28(21,22)14-10-8-13(2)9-11-14/h7-11,15-18H,1,12H2,2-6H3/t15-,16-,17-,18-/m1/s1
InChIKey KSZUKVXBIVTRFZ-BRSBDYLESA-N
Mol Weight 412.5 g/mol
Molecular Formula C20H28O7S
Exact Mass 412.155574 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BvI564cf7w9
Name (2R,3R,4R,5R)-(-)-1,2:4,5-Di(isopropylidenedioxy)hept-6-en-3-yl p-toluenesulfonate
Alternate Name(s) (R)-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl][(4R,5R)-5-ethenyl-2,2-dimethyl-1,3-dioxolan-4-yl]methyl 4-methylbenzene-1-sulfonate 4-Methylbenzenesulfonic acid [(R)-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-[(4R,5R)-5-ethenyl-2,2-dimethyl-1,3-dioxolan-4-yl]methyl] ester [(R)-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-[(4R,5R)-2,2-dimethyl-5-vinyl-1,3-dioxolan-4-yl]methyl] 4-methylbenzenesulfonate [(R)-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-[(4R,5R)-5-ethenyl-2,2-dimethyl-1,3-dioxolan-4-yl]methyl] 4-methylbenzenesulfonate
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Formula C20H28O7S
InChI InChI=1S/C20H28O7S/c1-7-15-17(26-20(5,6)24-15)18(16-12-23-19(3,4)25-16)27-28(21,22)14-10-8-13(2)9-11-14/h7-11,15-18H,1,12H2,2-6H3/t15-,16-,17-,18-/m1/s1
InChIKey KSZUKVXBIVTRFZ-BRSBDYLESA-N
Molecular Weight 412.497 g/mol
SMILES [C@@](OS(c1ccc(cc1)C)(=O)=O)([C@@]1(OC(C)(C)O[C@@]1(C=C)[H])[H])([C@@]1(OC(C)(C)OC1)[H])[H]
SPLASH splash10-0zfs-0902000000-e725a4aeb0fe0e854a65
Source of Spectrum SO-0-1436-3
Wiley ID 875044