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2,2,5-Trimethyl-3-hexanone
SpectraBase Compound ID KxSs6SkdiXP
InChI InChI=1S/C9H18O/c1-7(2)6-8(10)9(3,4)5/h7H,6H2,1-5H3
InChIKey LXFHNTKYSUCXRB-UHFFFAOYSA-N
Mol Weight 142.24 g/mol
Molecular Formula C9H18O
Exact Mass 142.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Q6GahOEmgb
Name 2,2,5-Trimethyl-3-hexanone
CAS Registry Number 14705-50-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H18O
InChI InChI=1S/C9H18O/c1-7(2)6-8(10)9(3,4)5/h7H,6H2,1-5H3
InChIKey LXFHNTKYSUCXRB-UHFFFAOYSA-N
Molecular Weight 142.242 g/mol
SMILES CC(C(CC(C)C)=O)(C)C
SPLASH splash10-0a4i-9000000000-d3f0373b6726dee17fe1
Source of Spectrum F4-44-2994-15
Synonyms 2,2,5-Trimethylhexan-3-one t-Butyl isobutyl ketone
Wiley ID 1716904