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(4-tert-butylphenyl)[(4S,5S)-5-(hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl 4-methylbenzenesulfonate
SpectraBase Compound ID JiSnlozHBX2
InChI InChI=1S/C24H32O6S/c1-16-7-13-19(14-8-16)31(26,27)30-21(22-20(15-25)28-24(5,6)29-22)17-9-11-18(12-10-17)23(2,3)4/h7-14,20-22,25H,15H2,1-6H3/t20-,21?,22-/m0/s1
InChIKey WBMSALCIKQZSOP-NHNZYLEHSA-N
Mol Weight 448.6 g/mol
Molecular Formula C24H32O6S
Exact Mass 448.19196 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A21NcafhqmH
Name (4-tert-butylphenyl)[(4S,5S)-5-(hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl 4-methylbenzenesulfonate
Alternate Name(s) (2S,3S)-(-)-2,3-O-Isopropylidene-1-O-tosyl4-tert-butylphenyl-L-threitol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H32O6S
InChI InChI=1S/C24H32O6S/c1-16-7-13-19(14-8-16)31(26,27)30-21(22-20(15-25)28-24(5,6)29-22)17-9-11-18(12-10-17)23(2,3)4/h7-14,20-22,25H,15H2,1-6H3/t20-,21?,22-/m0/s1
InChIKey WBMSALCIKQZSOP-NHNZYLEHSA-N
Molecular Weight 448.574 g/mol
SMILES OC[C@]1([C@@](C(OS(c2ccc(cc2)C)(=O)=O)c2ccc(C(C)(C)C)cc2)(OC(C)(C)O1)[H])[H]
SPLASH splash10-001j-0000900000-035305b115df8a8e13ed
Source of Spectrum KC-0-2226-4
Wiley ID 781767