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cis-2-tert-Butyl-5-oxocyclohexanecarbaldehyde
SpectraBase Compound ID HH5uQhK50YX
InChI InChI=1S/C11H18O2/c1-11(2,3)10-5-4-9(13)6-8(10)7-12/h7-8,10H,4-6H2,1-3H3/t8-,10-/m0/s1
InChIKey AOIXLMRRGOTMNI-WPRPVWTQSA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fp8xx2cZY82
Name cis-2-tert-Butyl-5-oxocyclohexanecarbaldehyde
Comments Less than 3 mono-isotopic peaks
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Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-11(2,3)10-5-4-9(13)6-8(10)7-12/h7-8,10H,4-6H2,1-3H3/t8-,10-/m0/s1
InChIKey AOIXLMRRGOTMNI-WPRPVWTQSA-N
Molecular Weight 182.263 g/mol
SMILES [C@@]1([C@@](CC(CC1)=O)(C=O)[H])(C(C)(C)C)[H]
SPLASH splash10-0a4i-9000000000-406951c8392206bb394b
Source of Spectrum J-62-5154-7
Synonyms (1R,2S)-2-tert-butyl-5-oxocyclohexanecarbaldehyde
Wiley ID 1178937