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(3R*,4S*)-4-(tert-Butyldimethylsilyl)-2-cyclohexyl-3-(4-methylphenyl)-1,2-thiazetidine 1,1-Dioxide
SpectraBase Compound ID JH5sqKYYd3M
InChI InChI=1S/C21H35NO2SSi/c1-16-12-14-17(15-13-16)19-20(26(5,6)21(2,3)4)25(23,24)22(19)18-10-8-7-9-11-18/h12-15,18-20H,7-11H2,1-6H3/t19-,20-/m1/s1
InChIKey JKQAFYMPFQDVKU-WOJBJXKFSA-N
Mol Weight 393.7 g/mol
Molecular Formula C21H35NO2SSi
Exact Mass 393.215777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EwVYHqj093D
Name (3R*,4S*)-4-(tert-Butyldimethylsilyl)-2-cyclohexyl-3-(4-methylphenyl)-1,2-thiazetidine 1,1-Dioxide
Alternate Name(s) (3R,4S)-4-[tert-butyl(dimethyl)silyl]-2-cyclohexyl-3-(4-methylphenyl)-1,2-thiazetidine 1,1-dioxide
Comments Less than 3 mono-isotopic peaks
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Formula C21H35NO2SSi
InChI InChI=1S/C21H35NO2SSi/c1-16-12-14-17(15-13-16)19-20(26(5,6)21(2,3)4)25(23,24)22(19)18-10-8-7-9-11-18/h12-15,18-20H,7-11H2,1-6H3/t19-,20-/m1/s1
InChIKey JKQAFYMPFQDVKU-WOJBJXKFSA-N
Molecular Weight 393.661 g/mol
SMILES [C@]1(S(N([C@@]1(c1ccc(cc1)C)[H])C1CCCCC1)(=O)=O)([Si](C(C)(C)C)(C)C)[H]
SPLASH splash10-000i-0009000000-17b5f9a0c214c7195890
Source of Spectrum E2-46-762-4
Wiley ID 1554445