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trans-(2,2,3,3-Tetramethyl-4-(methylsulfonyl)cyclobutyl)benzene
SpectraBase Compound ID JD91FY36txH
InChI InChI=1S/C15H22O2S/c1-14(2)12(11-9-7-6-8-10-11)13(15(14,3)4)18(5,16)17/h6-10,12-13H,1-5H3/t12-,13-/m0/s1
InChIKey CFBNYMNSKQJQDZ-STQMWFEESA-N
Mol Weight 266.4 g/mol
Molecular Formula C15H22O2S
Exact Mass 266.134051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2BsGZT4IIC
Name trans-(2,2,3,3-Tetramethyl-4-(methylsulfonyl)cyclobutyl)benzene
Appearance Colorless solid
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Formula C15H22O2S
InChI InChI=1S/C15H22O2S/c1-14(2)12(11-9-7-6-8-10-11)13(15(14,3)4)18(5,16)17/h6-10,12-13H,1-5H3/t12-,13-/m0/s1
InChIKey CFBNYMNSKQJQDZ-STQMWFEESA-N
Instrument Name Thermo Scientific DFS-HRMS
Ionization Type EI
Literature Reference DOI 10.1021/acs.orglett.1c01794
Molecular Weight 266.399 g/mol
Reported Formula C15H22O2(32)S
SMILES [C@@]1(S(=O)(=O)C)([C@](c2ccccc2)(C(C)(C)C1(C)C)[H])[H]
SPLASH splash10-001j-4900000000-04274cf306f0a60d853a
Sample Comments dr = 9:1
Source of Spectrum A1-23-SM62-4p
Thin-Layer Chromatography Rf = 0.58 (hexane/EtOAc, 1:1)
Wiley ID 1868073