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3,7,7-Trimethyl-1,3,8-nonatrien-5-one

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3,7,7-Trimethyl-1,3,8-nonatrien-5-one
SpectraBase Compound ID 7HS5hOSfhD8
InChI InChI=1S/C12H18O/c1-6-10(3)8-11(13)9-12(4,5)7-2/h6-8H,1-2,9H2,3-5H3/b10-8+
InChIKey ZPLWSKSIUSZLHW-CSKARUKUSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JaYOuhP64TG
Name 3,7,7-Trimethyl-1,3,8-nonatrien-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-6-10(3)8-11(13)9-12(4,5)7-2/h6-8H,1-2,9H2,3-5H3/b10-8+
InChIKey ZPLWSKSIUSZLHW-CSKARUKUSA-N
Molecular Weight 178.275 g/mol
SMILES C(\C=C\(C=C)C)(=O)CC(C=C)(C)C
SPLASH splash10-0002-9000000000-f1109a5b233bbec5d391
Source of Spectrum J-56-2834-7
Synonyms (3E)-3,7,7-trimethyl-1,3,8-nonatrien-5-one
Wiley ID 1174781