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(3S,4R)-3,4,5-tribenzoxypentan-2-one

View entire compound with spectra: 1 MS (GC)

(3S,4R)-3,4,5-tribenzoxypentan-2-one
SpectraBase Compound ID GV1ImNbDWDB
InChI InChI=1S/C26H28O4/c1-21(27)26(30-19-24-15-9-4-10-16-24)25(29-18-23-13-7-3-8-14-23)20-28-17-22-11-5-2-6-12-22/h2-16,25-26H,17-20H2,1H3/t25-,26-/m1/s1
InChIKey HEOSCBUPOFMCLJ-CLJLJLNGSA-N
Mol Weight 404.51 g/mol
Molecular Formula C26H28O4
Exact Mass 404.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CBpOgEKRFm6
Name (3S,4R)-3,4,5-tribenzoxypentan-2-one
Alternate Name(s) (3S,4R)-3,4,5-tribenzyloxypentan-2-one (3S,4R)-3,4,5-tris(phenylmethoxy)-2-pentanone (3S,4R)-3,4,5-tris(phenylmethoxy)pentan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H28O4
InChI InChI=1S/C26H28O4/c1-21(27)26(30-19-24-15-9-4-10-16-24)25(29-18-23-13-7-3-8-14-23)20-28-17-22-11-5-2-6-12-22/h2-16,25-26H,17-20H2,1H3/t25-,26-/m1/s1
InChIKey HEOSCBUPOFMCLJ-CLJLJLNGSA-N
Molecular Weight 404.506 g/mol
SMILES [C@](OCc1ccccc1)(C(=O)C)([C@](OCc1ccccc1)(COCc1ccccc1)[H])[H]
SPLASH splash10-0006-9220000000-7db14539a4a0816248f6
Source of Spectrum AT-39-2482-4
Wiley ID 854096