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(2R,3S,Rs)-3-(tert-Butyldimethylsilyloxy)-1-[(4-methylphenyl)sulfinyl]-4-phenylbutan-2-ol
SpectraBase Compound ID 4fzoITSn7P2
InChI InChI=1S/C23H34O3SSi/c1-18-12-14-20(15-13-18)27(25)17-21(24)22(16-19-10-8-7-9-11-19)26-28(5,6)23(2,3)4/h7-15,21-22,24H,16-17H2,1-6H3/t21?,22-,27?/m0/s1
InChIKey AILPMZJNABRQEE-ZVOVCPRUSA-N
Mol Weight 418.7 g/mol
Molecular Formula C23H34O3SSi
Exact Mass 418.199793 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FIRVuy9SRGm
Name (2R,3S,Rs)-3-(tert-Butyldimethylsilyloxy)-1-[(4-methylphenyl)sulfinyl]-4-phenylbutan-2-ol
Appearance White crystals
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Formula C23H34O3SSi
InChI InChI=1S/C23H34O3SSi/c1-18-12-14-20(15-13-18)27(25)17-21(24)22(16-19-10-8-7-9-11-19)26-28(5,6)23(2,3)4/h7-15,21-22,24H,16-17H2,1-6H3/t21?,22-,27?/m0/s1
InChIKey AILPMZJNABRQEE-ZVOVCPRUSA-N
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0010.221
Molecular Weight 418.667 g/mol
Optical Rotation [a]D = +35.0 (c = 1.0, CHCl3)
SMILES OC([C@](Cc1ccccc1)(O[Si](C(C)(C)C)(C)C)[H])C[S@+](c1ccc(cc1)C)[O-]
SPLASH splash10-03dr-5539000000-25f57950b5b80454fc44
Source of Spectrum ARK-2009-215-7
Wiley ID 1866612