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Toluene-4-sulfonic Acid [3-Methyl-3-(4-methylpent-3-enyl)oxiran-2-yl]methyl Ester
SpectraBase Compound ID I1bRyCFG35H
InChI InChI=1S/C17H24O4S/c1-13(2)6-5-11-17(4)16(21-17)12-20-22(18,19)15-9-7-14(3)8-10-15/h6-10,16H,5,11-12H2,1-4H3
InChIKey DPTURXDQMJHFIW-UHFFFAOYSA-N
Mol Weight 324.44 g/mol
Molecular Formula C17H24O4S
Exact Mass 324.13953 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LhMZrznJwDj
Name Toluene-4-sulfonic Acid [3-Methyl-3-(4-methylpent-3-enyl)oxiran-2-yl]methyl Ester
Alternate Name(s) [3-methyl-3-(4-methyl-3-pentenyl)-2-oxiranyl]methyl 4-methylbenzenesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O4S
InChI InChI=1S/C17H24O4S/c1-13(2)6-5-11-17(4)16(21-17)12-20-22(18,19)15-9-7-14(3)8-10-15/h6-10,16H,5,11-12H2,1-4H3
InChIKey DPTURXDQMJHFIW-UHFFFAOYSA-N
Molecular Weight 324.435 g/mol
SMILES C(OS(c1ccc(cc1)C)(=O)=O)C1OC1(CCC=C(C)C)C
SPLASH splash10-00or-0910000000-c577f585519bb88b7899
Source of Spectrum J-59-3443-7
Wiley ID 1323096