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1-HYDROXY-3,6,6-TRIMETHYLHEPTA-3,4-DIEN-2-YL-ACETATE
SpectraBase Compound ID IckDj3nFWsL
InChI InChI=1S/C12H20O3/c1-9(6-7-12(3,4)5)11(8-13)15-10(2)14/h7,11,13H,8H2,1-5H3/t6?,11-/m0/s1
InChIKey XZPKQGRUUPLCGB-NWFFHIACSA-N
Mol Weight 212.29 g/mol
Molecular Formula C12H20O3
Exact Mass 212.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CqC47tIyN3N
Name 1-HYDROXY-3,6,6-TRIMETHYLHEPTA-3,4-DIEN-2-YL-ACETATE
Compound Number 9A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H20O3
InChI InChI=1S/C12H20O3/c1-9(6-7-12(3,4)5)11(8-13)15-10(2)14/h7,11,13H,8H2,1-5H3/t6?,11-/m0/s1
InChIKey XZPKQGRUUPLCGB-NWFFHIACSA-N
Literature Reference Author B.GOCKEL,N.KRAUSE
Literature Reference Citation ORG.LETTERS,8,4485(2006)
Literature Reference DOI 10.1021/ol061669z
Molecular Weight 212.289 g/mol
Sample ID 61490
Solvent C6D6