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(2S)-N-Methyl-3-bromo-2-methyl-2-benzoyloxy-propionic acid amide
SpectraBase Compound ID 1DzjxrVqCxl
InChI InChI=1S/C12H14BrNO3/c1-12(8-13,11(16)14-2)17-10(15)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H,14,16)/t12-/m1/s1
InChIKey NWRQWGPALZUOKS-GFCCVEGCSA-N
Mol Weight 300.15 g/mol
Molecular Formula C12H14BrNO3
Exact Mass 299.015706 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9uYkbdIuIQI
Name (2S)-N-Methyl-3-bromo-2-methyl-2-benzoyloxy-propionic acid amide
Appearance White solid
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Exact Mass 299.015706312 u
Formula C12H14BrNO3
InChI InChI=1S/C12H14BrNO3/c1-12(8-13,11(16)14-2)17-10(15)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H,14,16)/t12-/m1/s1
InChIKey NWRQWGPALZUOKS-GFCCVEGCSA-N
Instrument Name Finnigan MAT SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/chem.201405888
Quality 52
Reported Formula C12H14O3NBr
SMILES N(C)C([C@@](OC(C1=CC=CC=C1)=O)(C)CBr)=O
SPLASH splash10-053r-1590000000-957c695340808746a4e6
Source of Spectrum QE-21-SM22-7b (DOI: 10.1002/chem.201405888)
Thin-Layer Chromatography 0.42 (hexane/EtOAc)
Wiley ID 1907044