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(S)-N-Trifluoromethanesulfonyl-3-bromovaline methyl ester
SpectraBase Compound ID 3UikEV065ms
InChI InChI=1S/C7H11BrF3NO4S/c1-6(2,8)4(5(13)16-3)12-17(14,15)7(9,10)11/h4,12H,1-3H3/t4-/m0/s1
InChIKey LRWSCGMPKBHXNR-BYPYZUCNSA-N
Mol Weight 342.13 g/mol
Molecular Formula C7H11BrF3NO4S
Exact Mass 340.954426 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5leOe4iNIbh
Name (S)-N-Trifluoromethanesulfonyl-3-bromovaline methyl ester
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Formula C7H11BrF3NO4S
InChI InChI=1S/C7H11BrF3NO4S/c1-6(2,8)4(5(13)16-3)12-17(14,15)7(9,10)11/h4,12H,1-3H3/t4-/m0/s1
InChIKey LRWSCGMPKBHXNR-BYPYZUCNSA-N
Molecular Weight 342.127 g/mol
SMILES N([C@@](C(=O)OC)(C(C)(C)Br)[H])S(=O)(=O)C(F)(F)F
SPLASH splash10-0fl0-2290000000-4e3d0f4e4792db6caf84
Source of Spectrum KD-14-2924-20
Synonyms Methyl (2S)-3-bromo-3-methyl-2-{[(trifluoromethyl)sulfonyl]amino}butanoate
Wiley ID 1636348