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(7S)-5-hydroxy-3-oxo-7,8-bis(phenylmethoxy)octanoic acid (phenylmethyl) ester
SpectraBase Compound ID HqYOmLMgVvF
InChI InChI=1S/C29H32O6/c30-26(16-27(31)18-29(32)35-21-25-14-8-3-9-15-25)17-28(34-20-24-12-6-2-7-13-24)22-33-19-23-10-4-1-5-11-23/h1-15,26,28,30H,16-22H2/t26?,28-/m0/s1
InChIKey ZBVIVOISECXPMG-RXBHZZDJSA-N
Mol Weight 476.6 g/mol
Molecular Formula C29H32O6
Exact Mass 476.219889 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BsIK3Kdoscv
Name (7S)-5-hydroxy-3-oxo-7,8-bis(phenylmethoxy)octanoic acid (phenylmethyl) ester
Alternate Name(s) (7S)-7,8-dibenzoxy-5-hydroxy-3-keto-caprylic acid benzyl ester (phenylmethyl) (7S)-5-oxidanyl-3-oxidanylidene-7,8-bis(phenylmethoxy)octanoate benzyl (7S)-5-hydroxy-3-oxo-7,8-bis(phenylmethoxy)octanoate benzyl (7S)-7,8-dibenzyloxy-5-hydroxy-3-oxo-octanoate
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Formula C29H32O6
InChI InChI=1S/C29H32O6/c30-26(16-27(31)18-29(32)35-21-25-14-8-3-9-15-25)17-28(34-20-24-12-6-2-7-13-24)22-33-19-23-10-4-1-5-11-23/h1-15,26,28,30H,16-22H2/t26?,28-/m0/s1
InChIKey ZBVIVOISECXPMG-RXBHZZDJSA-N
Molecular Weight 476.569 g/mol
SMILES OC(CC(CC(=O)OCc1ccccc1)=O)C[C@@](COCc1ccccc1)(OCc1ccccc1)[H]
SPLASH splash10-0006-9100000000-e50d3bb4251a892d61e1
Source of Spectrum E1-46-568-45
Wiley ID 1554321