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2-Cyclohexen-1-one, 6-hydroxy-3-(3-hydroxy-3-methyl-1,4-pentadienyl)-2,4,4-trimethyl-, [R-[R*,R*-(E)]]-
SpectraBase Compound ID 3lLpfMJeD7z
InChI InChI=1S/C15H22O3/c1-6-15(5,18)8-7-11-10(2)13(17)12(16)9-14(11,3)4/h6-8,12,16,18H,1,9H2,2-5H3/b8-7+/t12-,15-/m1/s1
InChIKey QHORVGMELGYNEB-HBCWJJAPSA-N
Mol Weight 250.34 g/mol
Molecular Formula C15H22O3
Exact Mass 250.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H17n9hO8TIq
Name 2-Cyclohexen-1-one, 6-hydroxy-3-(3-hydroxy-3-methyl-1,4-pentadienyl)-2,4,4-trimethyl-, [R-[R*,R*-(E)]]-
Alternate Name(s) (6R)-6-hydroxy-3-[(1E,3R)-3-hydroxy-3-methyl-1,4-pentadienyl]-2,4,4-trimethyl-2-cyclohexen-1-one 6-Hydroxy-3-(3-hydroxy-3-methyl-1,4-pentadienyl)-2,4,4-trimethyl-2-cyclohexenone
CAS Registry Number 80736-77-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O3
InChI InChI=1S/C15H22O3/c1-6-15(5,18)8-7-11-10(2)13(17)12(16)9-14(11,3)4/h6-8,12,16,18H,1,9H2,2-5H3/b8-7+/t12-,15-/m1/s1
InChIKey QHORVGMELGYNEB-HBCWJJAPSA-N
Molecular Weight 250.338 g/mol
SMILES O[C@]1(C(C(=C(\C=C\[C@@](C=C)(O)C)C(C1)(C)C)C)=O)[H]
SPLASH splash10-0abl-9730000000-28e8d760ab7a720e592a
Source of Spectrum H-64-2430-0
Wiley ID 1253553