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(2R,1'S)-2-[1'-Dibenzylamino)ethyl]-2-butyloxirane
SpectraBase Compound ID DKTZS45PcUm
InChI InChI=1S/C22H29NO/c1-3-4-15-22(18-24-22)19(2)23(16-20-11-7-5-8-12-20)17-21-13-9-6-10-14-21/h5-14,19H,3-4,15-18H2,1-2H3/t19-,22-/m1/s1
InChIKey KOQCGTBNWDRTKQ-DENIHFKCSA-N
Mol Weight 323.48 g/mol
Molecular Formula C22H29NO
Exact Mass 323.224915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4uftOy0UXvd
Name (2R,1'S)-2-[1'-Dibenzylamino)ethyl]-2-butyloxirane
Alternate Name(s) (1R)-N,N-dibenzyl-1-[(2S)-2-butyloxiranyl]ethanamine N,N-dibenzyl-N-{(1R)-1-[(2S)-2-butyloxiranyl]ethyl}amine
Comments Less than 3 mono-isotopic peaks
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Formula C22H29NO
InChI InChI=1S/C22H29NO/c1-3-4-15-22(18-24-22)19(2)23(16-20-11-7-5-8-12-20)17-21-13-9-6-10-14-21/h5-14,19H,3-4,15-18H2,1-2H3/t19-,22-/m1/s1
InChIKey KOQCGTBNWDRTKQ-DENIHFKCSA-N
Molecular Weight 323.480 g/mol
SMILES [C@@]1(OC1)([C@](N(Cc1ccccc1)Cc1ccccc1)(C)[H])CCCC
SPLASH splash10-00di-0090000000-13a051767e6b2cb43f27
Source of Spectrum J-62-5977-8
Wiley ID 1322688