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(2S)-N-Benzyl-2-benzyl-3-bromo-2-benzoyloxy-propionic acid amide
SpectraBase Compound ID EiB5gRboVxK
InChI InChI=1S/C24H22BrNO3/c25-18-24(16-19-10-4-1-5-11-19,29-22(27)21-14-8-3-9-15-21)23(28)26-17-20-12-6-2-7-13-20/h1-15H,16-18H2,(H,26,28)/t24-/m1/s1
InChIKey LYXQEYPWSJOAAW-XMMPIXPASA-N
Mol Weight 452.35 g/mol
Molecular Formula C24H22BrNO3
Exact Mass 451.078307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2FU0a4Oot1p
Name (2S)-N-Benzyl-2-benzyl-3-bromo-2-benzoyloxy-propionic acid amide
Appearance Orange oil
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Exact Mass 451.078306569 u
Formula C24H22BrNO3
InChI InChI=1S/C24H22BrNO3/c25-18-24(16-19-10-4-1-5-11-19,29-22(27)21-14-8-3-9-15-21)23(28)26-17-20-12-6-2-7-13-20/h1-15H,16-18H2,(H,26,28)/t24-/m1/s1
InChIKey LYXQEYPWSJOAAW-XMMPIXPASA-N
Instrument Name Finnigan MAT SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/chem.201405888
Molecular Weight 452.348 g/mol
Quality 144
Reported Formula C24H23O3NBr
SMILES N(CC1=CC=CC=C1)C([C@@](OC(C1=CC=CC=C1)=O)(CC1=CC=CC=C1)CBr)=O
SPLASH splash10-0udi-3492200000-fb755f3d542783c700b4
Source of Spectrum QE-21-SM26-7l (DOI: 10.1002/chem.201405888)
Thin-Layer Chromatography 0.26 (pentane/EtOAc, 8:2)
Wiley ID 1907051