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(2S,3S)-O1-Acetyl-3-dibenzylamino-4-phenylbutane-1,2-diol
SpectraBase Compound ID BTFuJHNnAMi
InChI InChI=1S/C26H29NO3/c1-21(28)30-20-26(29)25(17-22-11-5-2-6-12-22)27(18-23-13-7-3-8-14-23)19-24-15-9-4-10-16-24/h2-16,25-26,29H,17-20H2,1H3/t25-,26+/m0/s1
InChIKey CMZNZNSAXHGUBS-IZZNHLLZSA-N
Mol Weight 403.52 g/mol
Molecular Formula C26H29NO3
Exact Mass 403.214744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7WarghYdV8q
Name (2S,3S)-O1-Acetyl-3-dibenzylamino-4-phenylbutane-1,2-diol
Alternate Name(s) Acetic acid[(2S,3S)-3-(dibenzylamino)-2-hydroxy-4-phenyl-butyl]ester Acetic acid[(2S,3S)-3-[bis(phenylmethyl)amino]-2-hydroxy-4-phenylbutyl]ester [(2S,3S)-3-(dibenzylamino)-2-hydroxy-4-phenyl-butyl]acetate [(2S,3S)-3-[bis(phenylmethyl)amino]-2-oxidanyl-4-phenyl-butyl]ethanoate Acetic acid [(2S,3S)-3-[bis(phenylmethyl)amino]-2-hydroxy-4-phenylbutyl] ester [(2S,3S)-3-(dibenzylamino)-2-hydroxy-4-phenylbutyl] acetate [(2S,3S)-3-(dibenzylamino)-2-hydroxy-4-phenyl-butyl] acetate [(2S,3S)-3-[bis(phenylmethyl)amino]-2-oxidanyl-4-phenyl-butyl] ethanoate
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Formula C26H29NO3
InChI InChI=1S/C26H29NO3/c1-21(28)30-20-26(29)25(17-22-11-5-2-6-12-22)27(18-23-13-7-3-8-14-23)19-24-15-9-4-10-16-24/h2-16,25-26,29H,17-20H2,1H3/t25-,26+/m0/s1
InChIKey CMZNZNSAXHGUBS-IZZNHLLZSA-N
Molecular Weight 403.522 g/mol
SMILES O[C@](COC(=O)C)([C@](Cc1ccccc1)(N(Cc1ccccc1)Cc1ccccc1)[H])[H]
SPLASH splash10-001i-0093000000-8a9cd3a0ccf6a2d20e44
Source of Spectrum F-70-10353-9
Wiley ID 1597989