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1-(3,4-Epoxybutyl)-2-methyl-3,9-dioxatricyclo[3.3.1.0(2,4)]nonan-7-one
SpectraBase Compound ID Lh8Wp8lVwCx
InChI InChI=1S/2C12H16O4/c2*1-11-10(16-11)9-4-7(13)5-12(11,15-9)3-2-8-6-14-8/h2*8-10H,2-6H2,1H3/t2*8?,9-,10?,11?,12+/m00/s1
InChIKey LICJWNAIZZOFBI-KHRZAFPRSA-N
Mol Weight 448.51 g/mol
Molecular Formula C24H32O8
Exact Mass 448.209718 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4QFUosuJzku
Name 1-(3,4-EPOXYBUTYL)-2-METHYL-3,9-DIOXATRICYCLO-[3.3.1.0(2,4)]-NONAN-7-ONE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H32O8
InChI InChI=1S/2C12H16O4/c2*1-11-10(16-11)9-4-7(13)5-12(11,15-9)3-2-8-6-14-8/h2*8-10H,2-6H2,1H3/t2*8?,9-,10?,11?,12+/m00/s1
InChIKey LICJWNAIZZOFBI-KHRZAFPRSA-N
Literature Reference Author S.SENDELBACH,R.SCHWETZLER-RASCHKE,A.RADL,R.KAISER,G.H.HENLE, H.KORFANT,S.REINER,B
Literature Reference Citation J.ORG.CHEM.,64,3398(1999)
Literature Reference DOI 10.1021/jo972037g
Molecular Weight 448.513 g/mol
Sample ID 39782
Solvent CDCl3