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4-OXO-BETA-IONOL;3-(3'-HYDROXY-1'-BUTENYL)-2,4,4-TRIMETHYL-2-CYCLOHEXEN-1-ONE
SpectraBase Compound ID GNPUGSP23
InChI InChI=1S/C13H20O2/c1-9(14)5-6-11-10(2)12(15)7-8-13(11,3)4/h5-6,9,14H,7-8H2,1-4H3/b6-5+
InChIKey LWWWERIIOIAWQK-AATRIKPKSA-N
Mol Weight 208.3 g/mol
Molecular Formula C13H20O2
Exact Mass 208.14633 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 30jZMxqP9r6
Name 4-OXO-BETA-IONOL;3-(3'-HYDROXY-1'-BUTENYL)-2,4,4-TRIMETHYL-2-CYCLOHEXEN-1-ONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H20O2
InChI InChI=1S/C13H20O2/c1-9(14)5-6-11-10(2)12(15)7-8-13(11,3)4/h5-6,9,14H,7-8H2,1-4H3/b6-5+
InChIKey LWWWERIIOIAWQK-AATRIKPKSA-N
Literature Reference Author A.PABST,D.BARRON,E.SEMON,P.SCHREIER
Literature Reference Citation PHYTOCHEM.,31,4187(1992)
Literature Reference DOI 10.1016/0031-9422(92)80440-P
Molecular Weight 208.301 g/mol
Solvent CD3OD
Source File Reference UWMS27850