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2,7-Octadien-1-one, 4,4-dimethyl-1-phenyl-
SpectraBase Compound ID 8WlzjaRLcMp
InChI InChI=1S/C16H20O/c1-4-5-12-16(2,3)13-11-15(17)14-9-7-6-8-10-14/h4,6-11,13H,1,5,12H2,2-3H3/b13-11+
InChIKey NOXPNXMPWTWTGK-ACCUITESSA-N
Mol Weight 228.33 g/mol
Molecular Formula C16H20O
Exact Mass 228.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cwfi7zf4W39
Name 2,7-Octadien-1-one, 4,4-dimethyl-1-phenyl-
CAS Registry Number 97467-26-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O
InChI InChI=1S/C16H20O/c1-4-5-12-16(2,3)13-11-15(17)14-9-7-6-8-10-14/h4,6-11,13H,1,5,12H2,2-3H3/b13-11+
InChIKey NOXPNXMPWTWTGK-ACCUITESSA-N
Molecular Weight 228.335 g/mol
SMILES C(\C=C\C(CCC=C)(C)C)(=O)c1ccccc1
SPLASH splash10-0a4l-9700000000-171b80eaa56c5a1ebe36
Source of Spectrum J-50-3282-0
Synonyms (2E)-4,4-dimethyl-1-phenyl-2,7-octadien-1-one 4,4-Dimethyl-1-phenyl-2,7-octadien-1-one
Wiley ID 1230322