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(E)-4-(2,6,6-trimethyl-4-oxidanyl-cyclohexen-1-yl)but-2-enal
SpectraBase Compound ID GDnRDN20Gjf
InChI InChI=1S/C13H20O2/c1-10-8-11(15)9-13(2,3)12(10)6-4-5-7-14/h4-5,7,11,15H,6,8-9H2,1-3H3/b5-4+
InChIKey ANKSAMOZTOUQNL-SNAWJCMRSA-N
Mol Weight 208.3 g/mol
Molecular Formula C13H20O2
Exact Mass 208.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4hvnR0yGY8q
Name (E)-4-(2,6,6-trimethyl-4-oxidanyl-cyclohexen-1-yl)but-2-enal
Alternate Name(s) (E)-4-(4-hydroxy-2,6,6-trimethyl-1-cyclohexenyl)-2-butenal (E)-4-(4-hydroxy-2,6,6-trimethyl-cyclohexen-1-yl)but-2-enal
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Formula C13H20O2
InChI InChI=1S/C13H20O2/c1-10-8-11(15)9-13(2,3)12(10)6-4-5-7-14/h4-5,7,11,15H,6,8-9H2,1-3H3/b5-4+
InChIKey ANKSAMOZTOUQNL-SNAWJCMRSA-N
Molecular Weight 208.301 g/mol
SMILES OC1CC(C(=C(C1)C)C\C=C\C=O)(C)C
SPLASH splash10-0a4i-6900000000-4e007267edfacf2b59cf
Source of Spectrum HE-2006-59-4
Wiley ID 1613908