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EXO-2-METHYL-5-(HYDROXYMETHYLENE)-EXO,EXO-8,9-(ISOPROPYLIDENEDIOXY)-3-OXA-CIS-BICYCLO-[4.3.0]-NONAN-4-ONE
SpectraBase Compound ID B6MPPp5pZyo
InChI InChI=1S/C13H18O5/c1-6-10-7(8(5-14)12(15)16-6)4-9-11(10)18-13(2,3)17-9/h5-7,9-11,14H,4H2,1-3H3/b8-5+/t6-,7+,9-,10-,11-/m0/s1
InChIKey LBYHEHKRZUZIFL-DCBPOZBESA-N
Mol Weight 254.28 g/mol
Molecular Formula C13H18O5
Exact Mass 254.115424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JYxv9hXiUW5
Name EXO-2-METHYL-5-(HYDROXYMETHYLENE)-EXO,EXO-8,9-(ISOPROPYLIDENEDIOXY)-3-OXA-CIS-BICYCLO-[4.3.0]-NONAN-4-ONE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18O5
InChI InChI=1S/C13H18O5/c1-6-10-7(8(5-14)12(15)16-6)4-9-11(10)18-13(2,3)17-9/h5-7,9-11,14H,4H2,1-3H3/b8-5+/t6-,7+,9-,10-,11-/m0/s1
InChIKey LBYHEHKRZUZIFL-DCBPOZBESA-N
Literature Reference Author J.K.WHITESELL,P.K.S.WANG,D.A.AGUILAR
Literature Reference Citation J.ORG.CHEM.,48,2511(1983)
Literature Reference DOI 10.1021/jo00163a017
Molecular Weight 254.283 g/mol
Solvent CDCl3
Source File Reference UWCS13402