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(E,E)-2-Hydroxy-2,6,10-trimethyl-12-(tetrahydropyran-2-yloxy)dodeca-6,10-dien-3-yn-5-one
SpectraBase Compound ID AoZD6IybyWm
InChI InChI=1S/C20H30O4/c1-16(12-15-24-19-10-5-6-14-23-19)8-7-9-17(2)18(21)11-13-20(3,4)22/h9,12,19,22H,5-8,10,14-15H2,1-4H3/b16-12+,17-9+
InChIKey JPKBNPMBIAHDIN-QOVZJITASA-N
Mol Weight 334.46 g/mol
Molecular Formula C20H30O4
Exact Mass 334.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HyeWUphykdx
Name (E,E)-2-Hydroxy-2,6,10-trimethyl-12-(tetrahydropyran-2-yloxy)dodeca-6,10-dien-3-yn-5-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O4
InChI InChI=1S/C20H30O4/c1-16(12-15-24-19-10-5-6-14-23-19)8-7-9-17(2)18(21)11-13-20(3,4)22/h9,12,19,22H,5-8,10,14-15H2,1-4H3/b16-12+,17-9+
InChIKey JPKBNPMBIAHDIN-QOVZJITASA-N
Molecular Weight 334.456 g/mol
SMILES OC(C#CC(\C(=C\CC\C(=C\COC1OCCCC1)C)C)=O)(C)C
SPLASH splash10-0006-9000000000-e26bfc81890c2c41e0f2
Source of Spectrum AJ-72-282-1
Synonyms (6E,10E)-2-hydroxy-2,6,10-trimethyl-12-(tetrahydro-2H-pyran-2-yloxy)-6,10-dodecadien-3-yn-5-one (6E,10E)-2-hydroxy-2,6,10-trimethyl-12-(2-oxanyloxy)-5-dodeca-6,10-dien-3-ynone (6E,10E)-2-hydroxy-2,6,10-trimethyl-12-(oxan-2-yloxy)dodeca-6,10-dien-3-yn-5-one (6E,10E)-2,6,10-trimethyl-12-(oxan-2-yloxy)-2-oxidanyl-dodeca-6,10-dien-3-yn-5-one
Wiley ID 774871