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VPKMGDRERYMTJX-CMDGGOBGSA-N
SpectraBase Compound ID BYrs2AJ2SVo
InChI InChI=1S/C14H22O/c1-5-12(15)8-9-13-11(2)7-6-10-14(13,3)4/h7-9,13H,5-6,10H2,1-4H3/b9-8+
InChIKey VPKMGDRERYMTJX-CMDGGOBGSA-N
Mol Weight 206.33 g/mol
Molecular Formula C14H22O
Exact Mass 206.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GYL2AU9I9Mh
Name (1E)-1-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-1-penten-3-one
CAS Registry Number 7779-30-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O
InChI InChI=1S/C14H22O/c1-5-12(15)8-9-13-11(2)7-6-10-14(13,3)4/h7-9,13H,5-6,10H2,1-4H3/b9-8+
InChIKey VPKMGDRERYMTJX-CMDGGOBGSA-N
Molecular Weight 206.329 g/mol
SMILES C1(\C=C\C(=O)CC)C(=CCCC1(C)C)C
SPLASH splash10-0596-8910000000-19f9fae7ffb5334c6fbb
Source of Spectrum PR-347-0-0
Synonyms (E)-1-(2,6,6-trimethyl-1-cyclohex-2-enyl)-1-penten-3-one 1-Penten-3-one, 1-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, (E)- (E)-1-(2,6,6-trimethyl-2-cyclohexen-1-yl)pent-1-en-3-one (E)-1-(2,6,6-trimethylcyclohex-2-en-1-yl)pent-1-en-3-one .alpha.-N-Methyl ionone 1-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-1-penten-3-one Methyl ionone 1-2,6,6-Trimethylcyclohex-2-en-1-yl;pent-1-en-3-one 1-Penten-3-one, 1-(2,6,6-trimethyl-2-cyclohexen-1-yl)- EINECS 297-035-9
Wiley ID 1205252