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1,4-Cyclohexanedione, 2,2,6-trimethyl-
SpectraBase Compound ID 13YyqhrPR9F
InChI InChI=1S/C9H14O2/c1-6-4-7(10)5-9(2,3)8(6)11/h6H,4-5H2,1-3H3
InChIKey HVHHZSFNAYSPSA-UHFFFAOYSA-N
Mol Weight 154.21 g/mol
Molecular Formula C9H14O2
Exact Mass 154.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3FV1GHYc9wk
Name 2,2,6-trimethylcyclohexane-1,4-dione
Carrier Gas Helium (75 kPa) (2.5 ml/min)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 154.099379689 u
Formula C9H14O2
GC Column DB-Wax or DB-1 or DB-210 (30 m x 0.32 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 200oC
InChI InChI=1S/C9H14O2/c1-6-4-7(10)5-9(2,3)8(6)11/h6H,4-5H2,1-3H3
InChIKey HVHHZSFNAYSPSA-UHFFFAOYSA-N
Inlet Type Split (1:24)
Instrument Name Shimadzu GC 14A
Ionization Type EI
Literature Reference DOI 10.1002/jhrc.1240141118
Molecular Weight 154.209 g/mol
Quality 295
SMILES CC1CC(CC(C1=O)(C)C)=O
SPLASH splash10-0006-9100000000-ad87a9627fbf7c78bd43
Source of Spectrum HRC-14-773-12 (DOI: 10.1002/jhrc.1240141118)
Wiley ID 1910713