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(Z)-6-(2,3-Dimethyltricyclo[2.2.1.02,6]heptan-3-yl)-3-methylhex-3-en-2-one
SpectraBase Compound ID FaySdUSQ7rG
InChI InChI=1S/C16H24O/c1-10(11(2)17)6-5-7-15(3)12-8-13-14(9-12)16(13,15)4/h6,12-14H,5,7-9H2,1-4H3/b10-6-/t12-,13+,14-,15?,16+
InChIKey AJAXBERBECDKTL-DONLUSEWSA-N
Mol Weight 232.37 g/mol
Molecular Formula C16H24O
Exact Mass 232.182715 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DhF72Q2GDuM
Name (Z)-6-(2,3-Dimethyltricyclo[2.2.1.02,6]heptan-3-yl)-3-methylhex-3-en-2-one
Comments Computed using HOSE algorithm
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Exact Mass 232.182715392 u
Formula C16H24O
InChI InChI=1S/C16H24O/c1-10(11(2)17)6-5-7-15(3)12-8-13-14(9-12)16(13,15)4/h6,12-14H,5,7-9H2,1-4H3/b10-6-/t12-,13+,14-,15?,16+
InChIKey AJAXBERBECDKTL-DONLUSEWSA-N
Molecular Weight 232.367 g/mol
SMILES [C@@]12(C[C@]3(C([C@@]2([C@@]1(C3)[H])C)(CC\C=C/(C(=O)C)C)C)[H])[H]