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2-(4-Chlorophenyl)-1,1,1-trifluoro-4-(trimethylsilyl)butan-2-yl 4- methylbenzenesulfonate
SpectraBase Compound ID EgoSNLVQUtj
InChI InChI=1S/C20H24ClF3O3SSi/c1-15-5-11-18(12-6-15)28(25,26)27-19(20(22,23)24,13-14-29(2,3)4)16-7-9-17(21)10-8-16/h5-12H,13-14H2,1-4H3
InChIKey CWGWDLUSVVBROR-UHFFFAOYSA-N
Mol Weight 465.0 g/mol
Molecular Formula C20H24ClF3O3SSi
Exact Mass 464.085605 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H67WPXGO3wx
Name 2-(4-Chlorophenyl)-1,1,1-trifluoro-4-(trimethylsilyl)butan-2-yl 4- methylbenzenesulfonate
Alternate Name(s) 2-(4-Chlorophenyl)-1,1,1-trifluoro-4-(trimethylsilyl)butan-2-yl 4-methylbenzenesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24ClF3O3SSi
InChI InChI=1S/C20H24ClF3O3SSi/c1-15-5-11-18(12-6-15)28(25,26)27-19(20(22,23)24,13-14-29(2,3)4)16-7-9-17(21)10-8-16/h5-12H,13-14H2,1-4H3
InChIKey CWGWDLUSVVBROR-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c4sc01732c
Molecular Weight 465.002 g/mol
SMILES C(OS(c1ccc(cc1)C)(=O)=O)(c1ccc(cc1)Cl)(C(F)(F)F)CC[Si](C)(C)C
SPLASH splash10-0a4i-5791000000-b8f6e886670d4dbd99da
Source of Spectrum CSS-5-3983/SMS32-2b
Wiley ID 1755070