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3-Methyl-1-(4-methylphenyl)-7-oxo-2-octene
SpectraBase Compound ID 5B6oZr9AX0L
InChI InChI=1S/C16H22O/c1-13(5-4-6-15(3)17)7-10-16-11-8-14(2)9-12-16/h7-9,11-12H,4-6,10H2,1-3H3/b13-7+
InChIKey OKKDSQYCIZPDLN-NTUHNPAUSA-N
Mol Weight 230.35 g/mol
Molecular Formula C16H22O
Exact Mass 230.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID uqN1VpPstP
Name 3-Methyl-1-(4-methylphenyl)-7-oxo-2-octene
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O
InChI InChI=1S/C16H22O/c1-13(5-4-6-15(3)17)7-10-16-11-8-14(2)9-12-16/h7-9,11-12H,4-6,10H2,1-3H3/b13-7+
InChIKey OKKDSQYCIZPDLN-NTUHNPAUSA-N
Molecular Weight 230.351 g/mol
SMILES C(\C=C\(CCCC(C)=O)C)c1ccc(cc1)C
SPLASH splash10-052f-9700000000-9b879a3f7e89b9a8a3d6
Source of Spectrum SO-1978-614-5
Synonyms (6E)-6-methyl-8-(4-methylphenyl)-6-octen-2-one
Wiley ID 1537154