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3,5-Bis[.beta.-(4-acetoxy-3-methoxyphenyl)ethyl]isoxazol
SpectraBase Compound ID KtHzDpi51WX
InChI InChI=1S/C25H27NO7/c1-16(27)31-22-11-7-18(13-24(22)29-3)5-9-20-15-21(33-26-20)10-6-19-8-12-23(32-17(2)28)25(14-19)30-4/h7-8,11-15H,5-6,9-10H2,1-4H3
InChIKey LPYRVEMZNWIAKS-UHFFFAOYSA-N
Mol Weight 453.49 g/mol
Molecular Formula C25H27NO7
Exact Mass 453.178752 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9j0xOOrlh9R
Name 3,5-Bis[.beta.-(4-acetoxy-3-methoxyphenyl)ethyl]isoxazol
Alternate Name(s) 4-[2-(3-{2-[4-(acetyloxy)-3-methoxyphenyl]ethyl}-5-isoxazolyl)ethyl]-2-methoxyphenyl acetate
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Formula C25H27NO7
InChI InChI=1S/C25H27NO7/c1-16(27)31-22-11-7-18(13-24(22)29-3)5-9-20-15-21(33-26-20)10-6-19-8-12-23(32-17(2)28)25(14-19)30-4/h7-8,11-15H,5-6,9-10H2,1-4H3
InChIKey LPYRVEMZNWIAKS-UHFFFAOYSA-N
Molecular Weight 453.491 g/mol
SMILES c1(noc(c1)CCc1cc(c(cc1)OC(=O)C)OC)CCc1cc(c(cc1)OC(=O)C)OC
SPLASH splash10-03y0-0708900000-8bfffdb491413fe2b1fe
Source of Spectrum O1-65-54-6
Wiley ID 1592988