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(3R*,1'R*)-2-(1-tert-Butylethyl)3-phenyl-1,2-thiazetidine 1,1-dioxide
SpectraBase Compound ID 4rsroQh9Zfu
InChI InChI=1S/C14H21NO2S/c1-11(14(2,3)4)15-13(10-18(15,16)17)12-8-6-5-7-9-12/h5-9,11,13H,10H2,1-4H3/t11-,13+/m0/s1
InChIKey GACAFXKXNKNLFS-WCQYABFASA-N
Mol Weight 267.39 g/mol
Molecular Formula C14H21NO2S
Exact Mass 267.1293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4h1Vm7P2ppm
Name (3R*,1'R*)-2-(1-tert-Butylethyl)3-phenyl-1,2-thiazetidine 1,1-dioxide
Comments Less than 3 mono-isotopic peaks
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Formula C14H21NO2S
InChI InChI=1S/C14H21NO2S/c1-11(14(2,3)4)15-13(10-18(15,16)17)12-8-6-5-7-9-12/h5-9,11,13H,10H2,1-4H3/t11-,13+/m0/s1
InChIKey GACAFXKXNKNLFS-WCQYABFASA-N
Molecular Weight 267.387 g/mol
SMILES [C@](N1S(C[C@@]1(c1ccccc1)[H])(=O)=O)(C(C)(C)C)(C)[H]
SPLASH splash10-03di-0090000000-74dcc75d27a02db22de8
Source of Spectrum J-63-8358-14
Synonyms (3R)-3-phenyl-2-[(1R)-1,2,2-trimethylpropyl]-1,2-thiazetidine 1,1-dioxide (3S*,1'S*)-2-(1-tert-Butylethyl)3-phenyl-1,2-thiazetidine 1,1-dioxide (3S)-2-[(2S)-3,3-dimethylbutan-2-yl]-3-phenylthiazetidine 1,1-dioxide (3S)-2-[(2S)-3,3-dimethylbutan-2-yl]-3-phenyl-1,2-thiazetidine 1,1-dioxide
Wiley ID 1271118