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2-Hydroxy-2-(4,4-dimethyl-2,3-dioxabicyclo[3.3.1]nonyl)acetic acid ethyl ester

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2-Hydroxy-2-(4,4-dimethyl-2,3-dioxabicyclo[3.3.1]nonyl)acetic acid ethyl ester
SpectraBase Compound ID KaeQHiu6YxI
InChI InChI=1S/2C13H22O5/c2*1-4-16-11(15)10(14)13-7-5-6-9(8-13)12(2,3)17-18-13/h2*9-10,14H,4-8H2,1-3H3/t9-,10+,13+;9-,10-,13+/m11/s1
InChIKey NJKDWNLEVPARBI-PXGPCYBWSA-N
Mol Weight 516.63 g/mol
Molecular Formula C26H44O10
Exact Mass 516.293448 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E5fgv6Rjrvh
Name 2-HYDROXY-2-(4,4-DIMETHYL-2,3-DIOXABICYCLO-[3.3.1]-NONYL)-ACETIC-ACID-ETHYLESTER
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H44O10
InChI InChI=1S/2C13H22O5/c2*1-4-16-11(15)10(14)13-7-5-6-9(8-13)12(2,3)17-18-13/h2*9-10,14H,4-8H2,1-3H3/t9-,10+,13+;9-,10-,13+/m11/s1
InChIKey NJKDWNLEVPARBI-PXGPCYBWSA-N
Literature Reference Author T.TOKUYASU,S.KUNIKAWA,M.ABE,A.MASUYAMA,M.NOJIMA,H.S.KIM,K.BE GUM,Y.WATAYA
Literature Reference Citation J.ORG.CHEM.,68,7361(2003)
Literature Reference DOI 10.1021/jo030107f
Molecular Weight 516.629 g/mol
Solvent CDCl3
Source File Reference UWMS26725