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2-Hydroxymethyl-1-butanol bis(4-methylphenylsulfonate)

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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 IGlIgr9Jatl
Name
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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 412.1008
SMILES c1c(C)ccc(S(=O)(=O)OCC(COS(=O)(=O)c2ccc(C)cc2)CC)c1
SPLASH splash10-05mo-9400000000-584a08fcce8d02f8b5d1
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany