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tert-butyl-[[(1S)-2-methyl-1-(trichloromethyl)propyl]amino]-oxido-sulfonium
SpectraBase Compound ID 5mA65RmhRaa
InChI InChI=1S/C9H18Cl3NOS/c1-6(2)7(9(10,11)12)13-15(14)8(3,4)5/h6-7,13H,1-5H3/t7-,15?/m0/s1
InChIKey MHOPTMLVIIGQES-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 2atfOMouAln
Name tert-butyl-[[(1S)-2-methyl-1-(trichloromethyl)propyl]amino]-oxido-sulfonium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H18Cl3NOS
InChI InChI=1S/C9H18Cl3NOS/c1-6(2)7(9(10,11)12)13-15(14)8(3,4)5/h6-7,13H,1-5H3/t7-,15?/m0/s1
InChIKey MHOPTMLVIIGQES-CIFJEQONSA-N
Ionization Type EI
Molecular Weight 294.668 g/mol
Optical Rotation [a]25 = -42.1 (c = 1.10, CHCl3)
Reported Formula C9H18Cl3NOS
SMILES N([C@@](C(C)C)(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 1843876