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5,5,6-Trimethylhept-3-en-2-one

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 MS (GC)

5,5,6-Trimethylhept-3-en-2-one
SpectraBase Compound ID BsOWdgm0zFo
InChI InChI=1S/C10H18O/c1-8(2)10(4,5)7-6-9(3)11/h6-8H,1-5H3/b7-6+
InChIKey PVNRUOZFOQCTDV-VOTSOKGWSA-N
Mol Weight 154.25 g/mol
Molecular Formula C10H18O
Exact Mass 154.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ji3X6kPTKYx
Name 5,5,6-Trimethylhept-3-en-2-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O
InChI InChI=1S/C10H18O/c1-8(2)10(4,5)7-6-9(3)11/h6-8H,1-5H3/b7-6+
InChIKey PVNRUOZFOQCTDV-VOTSOKGWSA-N
Molecular Weight 154.253 g/mol
SMILES CC(C(C)C)(C)\C=C\C(=O)C
SPLASH splash10-01ox-9300000000-024ef2a1eb9c44a6ca54
Synonyms (3E)-5,5,6-Trimethyl-3-hepten-2-one (E)-5,5,6-trimethyl-3-hepten-2-one (E)-5,5,6-trimethylhept-3-en-2-one
Wiley ID 1484143