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3-[(4R,5R)-5-(3-tert-butoxy-3-keto-propyl)-2-phenyl-1,3-dioxolan-4-yl]propionic acid tert-butyl ester
SpectraBase Compound ID 3iScwFDZYGi
InChI InChI=1S/C23H34O6/c1-22(2,3)28-19(24)14-12-17-18(13-15-20(25)29-23(4,5)6)27-21(26-17)16-10-8-7-9-11-16/h7-11,17-18,21H,12-15H2,1-6H3/t17-,18-/m1/s1
InChIKey BKLBRQOSKQUDMN-QZTJIDSGSA-N
Mol Weight 406.5 g/mol
Molecular Formula C23H34O6
Exact Mass 406.235539 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5BAnR4okVs
Name 3-[(4R,5R)-5-(3-tert-butoxy-3-keto-propyl)-2-phenyl-1,3-dioxolan-4-yl]propionic acid tert-butyl ester
Alternate Name(s) 3-[(4R,5R)-5-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-2-phenyl-1,3-dioxolan-4-yl]propanoic acid tert-butyl ester tert-Butyl 3-[(4R,5R)-5-(3-tert-butoxy-3-oxo-propyl)-2-phenyl-1,3-dioxolan-4-yl]propanoate tert-Butyl 3-[(4R,5R)-5-[3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-propyl]-2-phenyl-1,3-dioxolan-4-yl]propanoate tert-Butyl 3-[(4R,5R)-5-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]-2-phenyl-1,3-dioxolan-4-yl]propanoate
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Formula C23H34O6
InChI InChI=1S/C23H34O6/c1-22(2,3)28-19(24)14-12-17-18(13-15-20(25)29-23(4,5)6)27-21(26-17)16-10-8-7-9-11-16/h7-11,17-18,21H,12-15H2,1-6H3/t17-,18-/m1/s1
InChIKey BKLBRQOSKQUDMN-QZTJIDSGSA-N
Molecular Weight 406.519 g/mol
SMILES C1(O[C@](CCC(OC(C)(C)C)=O)([C@](O1)(CCC(OC(C)(C)C)=O)[H])[H])c1ccccc1
SPLASH splash10-0a4r-3940000000-a841e2ba97e221f831f5
Source of Spectrum J-57-5038-2
Wiley ID 1372212