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4-HYDROPEROXY-2S,3R-ISOPROPYLIDEN-HEX-5-EN-1-OL_ACETATE
SpectraBase Compound ID 8L3k7yLrgKe
InChI InChI=1S/C12H20O4/c1-7(2)11(16-14)10-9(12(10,4)5)6-15-8(3)13/h9-11,14H,1,6H2,2-5H3/t9-,10-,11?/m1/s1
InChIKey CEQHLAVWIQXFHI-DIOIDXFWSA-N
Mol Weight 228.29 g/mol
Molecular Formula C12H20O4
Exact Mass 228.136159 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EfOFB1YJffs
Name 4-HYDROPEROXY-2S,3R-ISOPROPYLIDEN-HEX-5-EN-1-OL_ACETATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H20O4
InChI InChI=1S/C12H20O4/c1-7(2)11(16-14)10-9(12(10,4)5)6-15-8(3)13/h9-11,14H,1,6H2,2-5H3/t9-,10-,11?/m1/s1
InChIKey CEQHLAVWIQXFHI-DIOIDXFWSA-N
Literature Reference Author U.KASTNER,J.BREUER,S.GLASL,A.BAUMANN,W.ROBIEN,J.JURENITSCH,G .RUECKER,W.KUBELKA
Literature Reference Citation PLANTA.MED.,61,83(1995)
Literature Reference DOI 10.1055/s-2006-958010
Molecular Weight 228.288 g/mol
Solvent CDCl3
Source File Reference UIAP647