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(S)-1-(p-Toluenesulfonylmethyloxy)-2-methylpropylammonium bromide
SpectraBase Compound ID JTZmnjmBPnJ
InChI InChI=1S/C12H19NO3S.BrH/c1-9(2)12(13)8-16-17(14,15)11-6-4-10(3)5-7-11;/h4-7,9,12H,8,13H2,1-3H3;1H/t12-;/m1./s1
InChIKey DBGYGMWTFZJSHU-UTONKHPSSA-N
Mol Weight 338.26 g/mol
Molecular Formula C12H20BrNO3S
Exact Mass 337.034728 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 57gTx4729vF
Name (S)-1-(p-Toluenesulfonylmethyloxy)-2-methylpropylammonium bromide
Alternate Name(s) (2S)-3-methyl-1-{[(4-methylphenyl)sulfonyl]oxy}-2-butanaminium bromide (S)-1-(p-Toluenesulfonylmethyl)-2-methylpropylammonium bromide
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Formula C12H20BrNO3S
InChI InChI=1S/C12H19NO3S.BrH/c1-9(2)12(13)8-16-17(14,15)11-6-4-10(3)5-7-11;/h4-7,9,12H,8,13H2,1-3H3;1H/t12-;/m1./s1
InChIKey DBGYGMWTFZJSHU-UTONKHPSSA-N
Molecular Weight 338.260 g/mol
SMILES [Br-].[NH3+][C@](COS(c1ccc(C)cc1)(=O)=O)(C(C)C)[H]
SPLASH splash10-00di-9400000000-b06fe0b49d76f364ac76
Source of Spectrum F-56-777-3
Wiley ID 855843