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2-Hydroxymethyl-1-butanol bis(4-methylphenylsulfonate)
SpectraBase Compound ID 3joxV34tSeK
InChI InChI=1S/C19H24O6S2/c1-4-17(13-24-26(20,21)18-9-5-15(2)6-10-18)14-25-27(22,23)19-11-7-16(3)8-12-19/h5-12,17H,4,13-14H2,1-3H3
InChIKey WZYSFNQFJLHXQA-UHFFFAOYSA-N
Mol Weight 412.52 g/mol
Molecular Formula C19H24O6S2
Exact Mass 412.101431 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KdOGx7uWq7X
Name 2-Hydroxymethyl-1-butanol bis(4-methylphenylsulfonate)
Alternate Name(s) 2-(p-tolylsulfonyloxymethyl)butyl 4-methylbenzenesulfonate 2-[(4-methylphenyl)sulfonyloxymethyl]butyl 4-methylbenzenesulfonate 4-Methylbenzenesulfonic acid 2-(tosyloxymethyl)butyl ester 4-Methylbenzenesulfonic acid 2-[(4-methylphenyl)sulfonyloxymethyl]butyl ester
CAS Registry Number 24330-55-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H24O6S2
InChI InChI=1S/C19H24O6S2/c1-4-17(13-24-26(20,21)18-9-5-15(2)6-10-18)14-25-27(22,23)19-11-7-16(3)8-12-19/h5-12,17H,4,13-14H2,1-3H3
InChIKey WZYSFNQFJLHXQA-UHFFFAOYSA-N
Molecular Weight 412.515 g/mol
SMILES c1cc(ccc1C)S(OCC(CC)COS(c1ccc(cc1)C)(=O)=O)(=O)=O
SPLASH splash10-05mo-9400000000-3dd9e00d0295456d3e79
Wiley ID 1475279