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(2E,4E)-5-[(1S)-1-Hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dien-1-yl acetate

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(2E,4E)-5-[(1S)-1-Hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dien-1-yl acetate
SpectraBase Compound ID 2SM9lQjS2mV
InChI InChI=1S/C17H24O4/c1-12(7-9-21-14(3)18)6-8-17(20)13(2)10-15(19)11-16(17,4)5/h6-8,10,20H,9,11H2,1-5H3/b8-6+,12-7+/t17-/m1/s1
InChIKey LCXUYOLLIMGZLT-SRNVBJKFSA-N
Mol Weight 292.38 g/mol
Molecular Formula C17H24O4
Exact Mass 292.167459 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IqbW9jqFKVb
Name (2E,4E)-5-[(1S)-1-Hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dien-1-yl acetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 292.167459249 u
Formula C17H24O4
InChI InChI=1S/C17H24O4/c1-12(7-9-21-14(3)18)6-8-17(20)13(2)10-15(19)11-16(17,4)5/h6-8,10,20H,9,11H2,1-5H3/b8-6+,12-7+/t17-/m1/s1
InChIKey LCXUYOLLIMGZLT-SRNVBJKFSA-N
SMILES C1C(C=C([C@@](C1(C)C)(\C=C\C(=C\COC(=O)C)C)O)C)=O