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(2S)-2-(dibenzylamino)-4-methyl-1-[(2S,3R)-3-phenyloxiran-2-yl]pentan-1-one
SpectraBase Compound ID GGFxdYpLgH7
InChI InChI=1S/C28H31NO2/c1-21(2)18-25(26(30)28-27(31-28)24-16-10-5-11-17-24)29(19-22-12-6-3-7-13-22)20-23-14-8-4-9-15-23/h3-17,21,25,27-28H,18-20H2,1-2H3/t25-,27+,28+/m0/s1
InChIKey WUQHDUAEMPYBKL-KJYTXNCISA-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 KsuCLIRhLzs
Name (2S)-2-(dibenzylamino)-4-methyl-1-[(2S,3R)-3-phenyloxiran-2-yl]pentan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H31NO2
InChI InChI=1S/C28H31NO2/c1-21(2)18-25(26(30)28-27(31-28)24-16-10-5-11-17-24)29(19-22-12-6-3-7-13-22)20-23-14-8-4-9-15-23/h3-17,21,25,27-28H,18-20H2,1-2H3/t25-,27+,28+/m0/s1
InChIKey WUQHDUAEMPYBKL-KJYTXNCISA-N
Molecular Weight 413.561 g/mol
SMILES [C@]1(O[C@@]1(c1ccccc1)[H])(C([C@@](N(Cc1ccccc1)Cc1ccccc1)(CC(C)C)[H])=O)[H]
SPLASH splash10-004i-0090000000-58e281a8edc4e099e856
Source of Spectrum J-64-5051-2
Synonyms (2S)-2-[bis(phenylmethyl)amino]-4-methyl-1-[(2S,3R)-3-phenyl-2-oxiranyl]-1-pentanone (2S)-2-[bis(phenylmethyl)amino]-4-methyl-1-[(2S,3R)-3-phenyloxiran-2-yl]pentan-1-one
Wiley ID 1530622