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4-Hydroxy-3,5,5-trimethyl-2-cyclohexen-1-one
SpectraBase Compound ID 9Ry96PbnTvk
InChI InChI=1S/C9H14O2/c1-6-4-7(10)5-9(2,3)8(6)11/h4,8,11H,5H2,1-3H3
InChIKey RLDREDRZMOWDOA-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 B41qfSKLFtQ
Name 4-hydroxy-3,5,5-trimethylcyclohex-2-en-1-one
Carrier Gas Helium (75 kPa) (2.5 ml/min)
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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/h4,8,11H,5H2,1-3H3
InChIKey RLDREDRZMOWDOA-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 221
SMILES OC1C(=CC(CC1(C)C)=O)C
SPLASH splash10-01ow-9200000000-8d5d335477dc843a2c1d
Source of Spectrum HRC-14-773-9 (DOI: 10.1002/jhrc.1240141118)
Wiley ID 1910746