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3,6,6-trimethyl-2-cyclohexen-1-one
SpectraBase Compound ID 6v1CelxKzVl
InChI InChI=1S/C9H14O/c1-7-4-5-9(2,3)8(10)6-7/h6H,4-5H2,1-3H3
InChIKey DKUDUXARZQESDM-UHFFFAOYSA-N
Mol Weight 138.21 g/mol
Molecular Formula C9H14O
Exact Mass 138.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BV1g0fs8UfH
Name 3,6,6-trimethylcyclohex-2-en-1-one
Appearance Colorless liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 138.104465070 u
Formula C9H14O
GC Column HP-5 (30 m x 0.320 mm, film thickness 0.25 micrometer)
InChI InChI=1S/C9H14O/c1-7-4-5-9(2,3)8(10)6-7/h6H,4-5H2,1-3H3
InChIKey DKUDUXARZQESDM-UHFFFAOYSA-N
Instrument Name Agilent 6890N-5973
Ionization Type EI
Literature Reference DOI 10.1002/chem.201702680
Molecular Weight 138.210 g/mol
Quality 282
SMILES C1(CCC(=CC1=O)C)(C)C
SPLASH splash10-001i-9200000000-ea90f5e799af9471d680
Source of Spectrum QE-23-12907-16 (DOI: 10.1002/chem.201702680)
Wiley ID 1905802