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(1S,2S)-2-[(3E)-hexa-3,5-dienyl]-4-keto-cyclohexanecarbaldehyde
SpectraBase Compound ID DrQOCn3XY74
InChI InChI=1S/C13H18O2/c1-2-3-4-5-6-11-9-13(15)8-7-12(11)10-14/h2-4,10-12H,1,5-9H2/b4-3+/t11-,12+/m0/s1
InChIKey NDZKTHRQVLTWIF-HEKLCECKSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4sHhOKZY9Nr
Name (1S,2S)-2-[(3E)-hexa-3,5-dienyl]-4-keto-cyclohexanecarbaldehyde
Alternate Name(s) (1S,2S)-2-[(3E)-hexa-3,5-dienyl]-4-oxidanylidene-cyclohexane-1-carbaldehyde (1S,2S)-2-[(3E)-hexa-3,5-dienyl]-4-oxo-1-cyclohexanecarboxaldehyde (1S,2S)-2-[(3E)-hexa-3,5-dienyl]-4-oxo-cyclohexanecarbaldehyde (1S,2S)-2-[(3E)-hexa-3,5-dienyl]-4-oxocyclohexane-1-carbaldehyde
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Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-2-3-4-5-6-11-9-13(15)8-7-12(11)10-14/h2-4,10-12H,1,5-9H2/b4-3+/t11-,12+/m0/s1
InChIKey NDZKTHRQVLTWIF-HEKLCECKSA-N
Molecular Weight 206.285 g/mol
SMILES [C@]1(CC(=O)CC[C@@]1(C=O)[H])(CC\C=C\C=C)[H]
SPLASH splash10-014i-9120000000-4224820eb5b69d8b13c1
Source of Spectrum J-60-848-24
Wiley ID 1204835