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(R)-2,3-Dihydroxy-3-propylhexyl p-toluenesulfonate
SpectraBase Compound ID 9c9XRKfj76E
InChI InChI=1S/C16H26O5S/c1-4-10-16(18,11-5-2)15(17)12-21-22(19,20)14-8-6-13(3)7-9-14/h6-9,15,17-18H,4-5,10-12H2,1-3H3/t15-/m1/s1
InChIKey QPLFERVXTXQYBQ-OAHLLOKOSA-N
Mol Weight 330.44 g/mol
Molecular Formula C16H26O5S
Exact Mass 330.150095 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F0lpERJkQc4
Name (R)-2,3-Dihydroxy-3-propylhexyl p-toluenesulfonate
Alternate Name(s) (R)-2,3-dihydroxy-3-propylhexyl 4-methylbenzenesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26O5S
InChI InChI=1S/C16H26O5S/c1-4-10-16(18,11-5-2)15(17)12-21-22(19,20)14-8-6-13(3)7-9-14/h6-9,15,17-18H,4-5,10-12H2,1-3H3/t15-/m1/s1
InChIKey QPLFERVXTXQYBQ-OAHLLOKOSA-N
Molecular Weight 330.439 g/mol
SMILES OC([C@@](COS(c1ccc(cc1)C)(=O)=O)(O)[H])(CCC)CCC
SPLASH splash10-014i-0910000000-3cc12a2365eb932c3571
Source of Spectrum JF-332-196-8c
Wiley ID 1789627