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tert-butyl-oxido-[[(1S)-1-(trichloromethyl)butyl]amino]sulfonium
SpectraBase Compound ID 9Gb4JmZp4gm
InChI InChI=1S/C9H18Cl3NOS/c1-5-6-7(9(10,11)12)13-15(14)8(2,3)4/h7,13H,5-6H2,1-4H3/t7-,15?/m0/s1
InChIKey AOIILYXXRMRZQB-CIFJEQONSA-N
Mol Weight 294.67 g/mol
Molecular Formula C9H18Cl3NOS
Exact Mass 293.017468 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1eH2GvPOFj8
Name tert-butyl-oxido-[[(1S)-1-(trichloromethyl)butyl]amino]sulfonium
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Formula C9H18Cl3NOS
InChI InChI=1S/C9H18Cl3NOS/c1-5-6-7(9(10,11)12)13-15(14)8(2,3)4/h7,13H,5-6H2,1-4H3/t7-,15?/m0/s1
InChIKey AOIILYXXRMRZQB-CIFJEQONSA-N
Ionization Type EI
Molecular Weight 294.668 g/mol
Optical Rotation [a]25 = -59.4 (c = 0.61, CHCl3)
Reported Formula C9H18Cl3NOS
SMILES N([C@@](CCC)(C(Cl)(Cl)Cl)[H])[S@@+](C(C)(C)C)[O-]
SPLASH splash10-0a4i-9000000000-3f979a5a82ec557199d2
Sample Comments dr = 99:1
Source of Spectrum CN101857559A
Wiley ID 1843877