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(E)-(2S*,5R*)-2-Acetoxy-5-[benzyl(diphenylmethyl)amino]hex-3-ene
SpectraBase Compound ID 9QcroKXUxa7
InChI InChI=1S/C28H31NO2/c1-22(19-20-23(2)31-24(3)30)29(21-25-13-7-4-8-14-25)28(26-15-9-5-10-16-26)27-17-11-6-12-18-27/h4-20,22-23,28H,21H2,1-3H3/b20-19+/t22-,23+/m1/s1
InChIKey KIFRGURQLBBMMD-LUGJLRLLSA-N
Mol Weight 413.56 g/mol
Molecular Formula C28H31NO2
Exact Mass 413.235479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D3FrROILCg5
Name (E)-(2S*,5R*)-2-Acetoxy-5-[benzyl(diphenylmethyl)amino]hex-3-ene
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Formula C28H31NO2
InChI InChI=1S/C28H31NO2/c1-22(19-20-23(2)31-24(3)30)29(21-25-13-7-4-8-14-25)28(26-15-9-5-10-16-26)27-17-11-6-12-18-27/h4-20,22-23,28H,21H2,1-3H3/b20-19+/t22-,23+/m1/s1
InChIKey KIFRGURQLBBMMD-LUGJLRLLSA-N
Molecular Weight 413.561 g/mol
SMILES C(N(Cc1ccccc1)[C@@](\C=C\[C@@](OC(=O)C)(C)[H])(C)[H])(c1ccccc1)c1ccccc1
SPLASH splash10-014j-0904000000-a441d88aebb0b18766cb
Source of Spectrum C-120-6668-14
Synonyms (1S,2E,4R)-4-[benzhydryl(benzyl)amino]-1-methyl-2-pentenyl acetate
Wiley ID 761056