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2,6,6-trimethyl-3-oxocyclohexa-1,4-diene-1-carboxaldehyde
SpectraBase Compound ID GzRyMaUeK0B
InChI InChI=1S/C10H12O2/c1-7-8(6-11)10(2,3)5-4-9(7)12/h4-6H,1-3H3
InChIKey LSVCALPURHFYTI-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 CpggcQjTuHL
Name 2,6,6-trimethyl-3-oxocyclohexa-1,4-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/c1-7-8(6-11)10(2,3)5-4-9(7)12/h4-6H,1-3H3
InChIKey LSVCALPURHFYTI-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 183
SMILES CC1(C=CC(C(=C1C=O)C)=O)C
SPLASH splash10-0006-9300000000-f8cc5a4844c93f6f8282
Source of Spectrum HRC-14-773-21 (DOI: 10.1002/jhrc.1240141118)
Wiley ID 1910723