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1,2:5,6-Di-O isopropylidene-.alpha.,D-allofuranose-3-O-(4-tert-Butylphenyl)methanesulfonyl
SpectraBase Compound ID Gv87urxf1ct
InChI InChI=1S/C23H34O8S/c1-21(2,3)15-10-8-14(9-11-15)13-32(24,25)31-18-17(16-12-26-22(4,5)28-16)27-20-19(18)29-23(6,7)30-20/h8-11,16-20H,12-13H2,1-7H3/t16?,17-,18-,19-,20-/m1/s1
InChIKey BXIGELUYBIPUNL-VYSFZAHKSA-N
Mol Weight 470.6 g/mol
Molecular Formula C23H34O8S
Exact Mass 470.197439 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID II3ufqjzJo9
Name 1,2:5,6-Di-O isopropylidene-.alpha.,D-allofuranose-3-O-(4-tert-Butylphenyl)methanesulfonyl
Alternate Name(s) (3aR,5R,6R,6aR)-5-(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-tetrahydro-2H-furo[2,3-d][1,3]dioxol-6-yl (4-tert-butylphenyl)methanesulfonate 1,2:5,6-Di-O isopropylidene-.alpha.,D-allofuranose (4-tert-Butylphenyl)methanesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H34O8S
InChI InChI=1S/C23H34O8S/c1-21(2,3)15-10-8-14(9-11-15)13-32(24,25)31-18-17(16-12-26-22(4,5)28-16)27-20-19(18)29-23(6,7)30-20/h8-11,16-20H,12-13H2,1-7H3/t16?,17-,18-,19-,20-/m1/s1
InChIKey BXIGELUYBIPUNL-VYSFZAHKSA-N
Molecular Weight 470.577 g/mol
SMILES [C@]1([C@@]2([C@@](OC(O2)(C)C)(O[C@@]1(C1OC(C)(C)OC1)[H])[H])[H])(OS(=O)(=O)Cc1ccc(C(C)(C)C)cc1)[H]
SPLASH splash10-052b-0900500000-225b6b67a08d9b8b0515
Source of Spectrum KC-61-3238-18
Wiley ID 1628346