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(2R,3S)-3-[1-(Benzyloxy)-2-butoxy]-2-hydroxybutyl tosylate
SpectraBase Compound ID HHHkc43dGvi
InChI InChI=1S/C22H30O6S/c1-4-20(15-26-14-19-8-6-5-7-9-19)28-18(3)22(23)16-27-29(24,25)21-12-10-17(2)11-13-21/h5-13,18,20,22-23H,4,14-16H2,1-3H3/t18-,20?,22+/m0/s1
InChIKey YIEWNAQKDUQVSJ-VRTQEHCBSA-N
Mol Weight 422.54 g/mol
Molecular Formula C22H30O6S
Exact Mass 422.17631 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D9OG3fBeHdl
Name (2R,3S)-3-[1-(Benzyloxy)-2-butoxy]-2-hydroxybutyl tosylate
Alternate Name(s) (2R,3S)-3-{1-[(benzyloxy)methyl]propoxy}-2-hydroxybutyl 4-methylbenzenesulfonate 3-[1-(Benzyloxy)-2-butoxy]-2-hydroxybutyl tosylate Toluene-4-sulfonic acid (2R,3S)-3-(1-benzyloxymethyl-propoxy)-2-hydroxy-butyl ester
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Formula C22H30O6S
InChI InChI=1S/C22H30O6S/c1-4-20(15-26-14-19-8-6-5-7-9-19)28-18(3)22(23)16-27-29(24,25)21-12-10-17(2)11-13-21/h5-13,18,20,22-23H,4,14-16H2,1-3H3/t18-,20?,22+/m0/s1
InChIKey YIEWNAQKDUQVSJ-VRTQEHCBSA-N
Molecular Weight 422.536 g/mol
SMILES O[C@](COS(c1ccc(cc1)C)(=O)=O)([C@@](OC(COCc1ccccc1)CC)(C)[H])[H]
SPLASH splash10-0006-9200000000-93a0dd3b8f342c4fc682
Source of Spectrum F-51-150-3
Wiley ID 790470