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4-Hexen-3-one, 1-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, (E)-
SpectraBase Compound ID 5DaByYRU2aP
InChI InChI=1S/C15H24O/c1-5-7-13(16)9-10-14-12(2)8-6-11-15(14,3)4/h5,7-8,14H,6,9-11H2,1-4H3/b7-5+
InChIKey SYQBTBCCDLKBQT-FNORWQNLSA-N
Mol Weight 220.36 g/mol
Molecular Formula C15H24O
Exact Mass 220.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CHSpinOoau2
Name 4-Hexen-3-one, 1-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, (E)-
CAS Registry Number 106201-52-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O
InChI InChI=1S/C15H24O/c1-5-7-13(16)9-10-14-12(2)8-6-11-15(14,3)4/h5,7-8,14H,6,9-11H2,1-4H3/b7-5+
InChIKey SYQBTBCCDLKBQT-FNORWQNLSA-N
Molecular Weight 220.356 g/mol
SMILES C1(C(=CCCC1(C)C)C)CCC(\C=C\C)=O
SPLASH splash10-00r6-9400000000-86be697c530a2b6425af
Source of Spectrum H-68-1972-65
Synonyms (4E)-1-(2,6,6-trimethyl-2-cyclohexen-1-yl)-4-hexen-3-one (4E)-1-(2,6,6-trimethyl-2-cyclohexenyl)-4-hexen-3-on
Wiley ID 1220748