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(2S)-N-Benzyl-3-bromo-2-phenyl-2-benzoyloxy-propionic acid amide
SpectraBase Compound ID 1E59WUpWmgS
InChI InChI=1S/C23H20BrNO3/c24-17-23(20-14-8-3-9-15-20,28-21(26)19-12-6-2-7-13-19)22(27)25-16-18-10-4-1-5-11-18/h1-15H,16-17H2,(H,25,27)/t23-/m0/s1
InChIKey KVWJRWCIDNRXKS-QHCPKHFHSA-N
Mol Weight 438.32 g/mol
Molecular Formula C23H20BrNO3
Exact Mass 437.062657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HLx1oUiTd6
Name (2S)-N-Benzyl-3-bromo-2-phenyl-2-benzoyloxy-propionic acid amide
Appearance White solid
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Exact Mass 437.062656505 u
Formula C23H20BrNO3
InChI InChI=1S/C23H20BrNO3/c24-17-23(20-14-8-3-9-15-20,28-21(26)19-12-6-2-7-13-19)22(27)25-16-18-10-4-1-5-11-18/h1-15H,16-17H2,(H,25,27)/t23-/m0/s1
InChIKey KVWJRWCIDNRXKS-QHCPKHFHSA-N
Instrument Name Finnigan MAT SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/chem.201405888
Molecular Weight 438.321 g/mol
Quality 155
Reported Formula C23H20O3NBr
SMILES N(CC1=CC=CC=C1)C([C@@](OC(C1=CC=CC=C1)=O)(C1=CC=CC=C1)CBr)=O
SPLASH splash10-05dl-5590000000-2f60169f65386f5186cd
Source of Spectrum QE-21-SM26-7k (DOI: 10.1002/chem.201405888)
Thin-Layer Chromatography 0.14 (hexane/EtOAc, 8:1)
Wiley ID 1907050