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trans-((2,2,3,3-Tetramethyl-4-phenylcyclobutyl)sulfonyl)benzene
SpectraBase Compound ID FlRCYEwc0HW
InChI InChI=1S/C20H24O2S/c1-19(2)17(15-11-7-5-8-12-15)18(20(19,3)4)23(21,22)16-13-9-6-10-14-16/h5-14,17-18H,1-4H3/t17-,18-/m0/s1
InChIKey ITKOLYBMIUZQQT-ROUUACIJSA-N
Mol Weight 328.47 g/mol
Molecular Formula C20H24O2S
Exact Mass 328.149701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 94lM2ie3p8O
Name trans-((2,2,3,3-Tetramethyl-4-phenylcyclobutyl)sulfonyl)benzene
Appearance Colorless solid
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Formula C20H24O2S
InChI InChI=1S/C20H24O2S/c1-19(2)17(15-11-7-5-8-12-15)18(20(19,3)4)23(21,22)16-13-9-6-10-14-16/h5-14,17-18H,1-4H3/t17-,18-/m0/s1
InChIKey ITKOLYBMIUZQQT-ROUUACIJSA-N
Instrument Name Thermo Scientific DFS-HRMS
Ionization Type EI
Literature Reference DOI 10.1021/acs.orglett.1c01794
Molecular Weight 328.470 g/mol
Reported Formula C20H24O2(32)S
SMILES [C@@]1(S(=O)(=O)c2ccccc2)([C@](c2ccccc2)(C(C)(C)C1(C)C)[H])[H]
SPLASH splash10-0012-2900000000-e9c3324196c54035c13d
Source of Spectrum A1-23-SM44-4a
Thin-Layer Chromatography Rf = 0.65 (hexane/EtOAc, 2:1)
Wiley ID 1868059