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2-[4-(2-methylphenoxy)phenoxy]ethyl 4-methylbenzenesulfonate
SpectraBase Compound ID J3UsR3vYDss
InChI InChI=1S/C22H22O5S/c1-17-7-13-21(14-8-17)28(23,24)26-16-15-25-19-9-11-20(12-10-19)27-22-6-4-3-5-18(22)2/h3-14H,15-16H2,1-2H3
InChIKey DAULNOLBJVWCBQ-UHFFFAOYSA-N
Mol Weight 398.47 g/mol
Molecular Formula C22H22O5S
Exact Mass 398.118795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Amq4U88jePQ
Name 2-[4-(2-methylphenoxy)phenoxy]ethyl 4-methylbenzenesulfonate
Alternate Name(s) 4-Methylbenzenesulfonic acid 2-[4-(2-methylphenoxy)phenoxy]ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22O5S
InChI InChI=1S/C22H22O5S/c1-17-7-13-21(14-8-17)28(23,24)26-16-15-25-19-9-11-20(12-10-19)27-22-6-4-3-5-18(22)2/h3-14H,15-16H2,1-2H3
InChIKey DAULNOLBJVWCBQ-UHFFFAOYSA-N
Molecular Weight 398.473 g/mol
SMILES c1(S(=O)(=O)OCCOc2ccc(Oc3c(C)cccc3)cc2)ccc(cc1)C
SPLASH splash10-0005-6902000000-f3aaa6b561d0cccc255c
Source of Spectrum F2-43-1837-71
Wiley ID 1600634