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(E)-1-(4-(4-methylhepta-2,3,5-trien-2-yl)phenyl)ethanone
SpectraBase Compound ID CFNmHDZig10
InChI InChI=1S/C16H18O/c1-5-6-12(2)11-13(3)15-7-9-16(10-8-15)14(4)17/h5-10H,1-4H3/b6-5+
InChIKey AVATUZVLHKYKAO-AATRIKPKSA-N
Mol Weight 226.32 g/mol
Molecular Formula C16H18O
Exact Mass 226.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GMctYIQaSYx
Name (E)-1-(4-(4-methylhepta-2,3,5-trien-2-yl)phenyl)ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O
InChI InChI=1S/C16H18O/c1-5-6-12(2)11-13(3)15-7-9-16(10-8-15)14(4)17/h5-10H,1-4H3/b6-5+
InChIKey AVATUZVLHKYKAO-AATRIKPKSA-N
Literature Reference DOI 10.1021/jo200201r
Molecular Weight 226.319 g/mol
SMILES C(c1ccc(cc1)C(C)=O)(=C=C(\C=C\C)C)C
SPLASH splash10-004i-0890000000-171ed03db579ce859f1a
Source of Spectrum J-76-5967-3ac
Synonyms 1-[4-[(5E)-4-methylhepta-2,3,5-trien-2-yl]phenyl]ethanone
Wiley ID 1746689