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(2S,3S)-O1-Penta-2-enoyl-3-dibenzylamino-4-phenylbutane-1,2-diol
SpectraBase Compound ID 5vsHD5pE1rF
InChI InChI=1S/C29H33NO3/c1-2-3-19-29(32)33-23-28(31)27(20-24-13-7-4-8-14-24)30(21-25-15-9-5-10-16-25)22-26-17-11-6-12-18-26/h3-19,27-28,31H,2,20-23H2,1H3/b19-3+/t27-,28+/m0/s1
InChIKey NYEZVINCEJVQNO-OTVSBJOASA-N
Mol Weight 443.6 g/mol
Molecular Formula C29H33NO3
Exact Mass 443.246044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jr1tPSlXx8r
Name (2S,3S)-O1-Penta-2-enoyl-3-dibenzylamino-4-phenylbutane-1,2-diol
Alternate Name(s) (2S,3S)-3-(dibenzylamino)-2-hydroxy-4-phenylbutyl (2E)-2-pentenoate (E)-2-pentenoic acid [(2S,3S)-3-[bis(phenylmethyl)amino]-2-hydroxy-4-phenylbutyl] ester [(2S,3S)-3-(dibenzylamino)-2-hydroxy-4-phenylbutyl] (E)-pent-2-enoate [(2S,3S)-3-(dibenzylamino)-2-hydroxy-4-phenyl-butyl] (E)-pent-2-enoate [(2S,3S)-3-[bis(phenylmethyl)amino]-2-oxidanyl-4-phenyl-butyl] (E)-pent-2-enoate
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Formula C29H33NO3
InChI InChI=1S/C29H33NO3/c1-2-3-19-29(32)33-23-28(31)27(20-24-13-7-4-8-14-24)30(21-25-15-9-5-10-16-25)22-26-17-11-6-12-18-26/h3-19,27-28,31H,2,20-23H2,1H3/b19-3+/t27-,28+/m0/s1
InChIKey NYEZVINCEJVQNO-OTVSBJOASA-N
Molecular Weight 443.587 g/mol
SMILES O[C@](COC(\C=C\CC)=O)([C@](Cc1ccccc1)(N(Cc1ccccc1)Cc1ccccc1)[H])[H]
SPLASH splash10-00dr-0009000000-fc92674ed86bd8f774d3
Source of Spectrum F-70-10353-9
Wiley ID 1597988