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5,5-Dimethyl-1-phenyl-2(E)-octen-1,7-dione
SpectraBase Compound ID 9ZX2iRSneGB
InChI InChI=1S/C16H20O2/c1-13(17)12-16(2,3)11-7-10-15(18)14-8-5-4-6-9-14/h4-10H,11-12H2,1-3H3/b10-7+
InChIKey SWABZKUZVSOHMC-JXMROGBWSA-N
Mol Weight 244.33 g/mol
Molecular Formula C16H20O2
Exact Mass 244.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1DsPqpWBnv8
Name 5,5-Dimethyl-1-phenyl-2(E)-octen-1,7-dione
Alternate Name(s) (2E)-5,5-dimethyl-1-phenyl-2-octene-1,7-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O2
InChI InChI=1S/C16H20O2/c1-13(17)12-16(2,3)11-7-10-15(18)14-8-5-4-6-9-14/h4-10H,11-12H2,1-3H3/b10-7+
InChIKey SWABZKUZVSOHMC-JXMROGBWSA-N
Molecular Weight 244.334 g/mol
SMILES C(\C=C\CC(CC(=O)C)(C)C)(=O)c1ccccc1
SPLASH splash10-059b-0900000000-1850a85baab569be5c84
Source of Spectrum F-56-9276-5
Wiley ID 859193