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2,6,6-trimethyl-5-oxo-cyclohexa-1,3-diene-1-carboxaldehyde
SpectraBase Compound ID 6nFwmGUzWs
InChI InChI=1S/C10H12O2/c1-7-4-5-9(12)10(2,3)8(7)6-11/h4-6H,1-3H3
InChIKey IRKKMMCRSGGEBE-UHFFFAOYSA-N
Mol Weight 164.2 g/mol
Molecular Formula C10H12O2
Exact Mass 164.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 46yexx71192
Name 2,6,6-trimethyl-5-oxo-cyclohexa-1,3-diene-1-carboxaldehyde
Carrier Gas Helium (75 kPa) (2.5 ml/min)
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Exact Mass 164.083729624 u
Formula C10H12O2
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/C10H12O2/c1-7-4-5-9(12)10(2,3)8(7)6-11/h4-6H,1-3H3
InChIKey IRKKMMCRSGGEBE-UHFFFAOYSA-N
Inlet Type Split (1:24)
Instrument Name Shimadzu GC 14A
Ionization Type EI
Literature Reference DOI 10.1002/jhrc.1240141118
Molecular Weight 164.204 g/mol
Quality 214
SMILES CC1(C(C=CC(=C1C=O)C)=O)C
SPLASH splash10-0006-9300000000-8419c7d6b912ea943028
Source of Spectrum HRC-14-773-23 (DOI: 10.1002/jhrc.1240141118)
Wiley ID 1910725