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(+)-(1R,2R,3S)-2-(1-n-Butyl-2-isobutylcarbonyloxy-3-hydroxybutyl)-4,5-diphenyloxazole
SpectraBase Compound ID 3d22LgopRpr
InChI InChI=1S/C28H35NO4/c1-5-6-17-23(26(20(4)30)32-24(31)18-19(2)3)28-29-25(21-13-9-7-10-14-21)27(33-28)22-15-11-8-12-16-22/h7-16,19-20,23,26,30H,5-6,17-18H2,1-4H3/t20-,23+,26-/m0/s1
InChIKey MSNXBBIHJIMRRI-CLLDFNAGSA-N
Mol Weight 449.6 g/mol
Molecular Formula C28H35NO4
Exact Mass 449.256609 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1lrsnXFqCzM
Name (+)-(1R,2R,3S)-2-(1-n-Butyl-2-isobutylcarbonyloxy-3-hydroxybutyl)-4,5-diphenyloxazole
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Formula C28H35NO4
InChI InChI=1S/C28H35NO4/c1-5-6-17-23(26(20(4)30)32-24(31)18-19(2)3)28-29-25(21-13-9-7-10-14-21)27(33-28)22-15-11-8-12-16-22/h7-16,19-20,23,26,30H,5-6,17-18H2,1-4H3/t20-,23+,26-/m0/s1
InChIKey MSNXBBIHJIMRRI-CLLDFNAGSA-N
Molecular Weight 449.591 g/mol
SMILES O[C@]([C@@]([C@](c1nc(-c2ccccc2)c(o1)-c1ccccc1)(CCCC)[H])(OC(=O)CC(C)C)[H])(C)[H]
SPLASH splash10-0udi-0009100000-e22c2e0037babd22fa10
Source of Spectrum F-48-7067-14
Synonyms (1R,2R)-2-(4,5-diphenyl-1,3-oxazol-2-yl)-1-[(1S)-1-hydroxyethyl]hexyl 3-methylbutanoate
Wiley ID 1387499