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2,4,6-Trimethylbicyclo[4.3.0]non-4-en-3-one
SpectraBase Compound ID 2kya0Eo9GMV
InChI InChI=1S/C12H18O/c1-8-7-12(3)6-4-5-10(12)9(2)11(8)13/h7,9-10H,4-6H2,1-3H3/t9-,10+,12-/m1/s1
InChIKey QQVHWPJZYBILNM-JFGNBEQYSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 45TLrOUcJNH
Name 2,4,6-Trimethylbicyclo[4.3.0]non-4-en-3-one
Alternate Name(s) (3aS,4R,7aS)-4,6,7a-Trimethyl-1,2,3,3a,4,7a-hexahydro-inden-5-one 4,6,7a-trimethyl-1,2,3,3a,4,7a-hexahydro-5H-inden-5-one
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Formula C12H18O
InChI InChI=1S/C12H18O/c1-8-7-12(3)6-4-5-10(12)9(2)11(8)13/h7,9-10H,4-6H2,1-3H3/t9-,10+,12-/m1/s1
InChIKey QQVHWPJZYBILNM-JFGNBEQYSA-N
Molecular Weight 178.275 g/mol
SMILES [C@@]12(C=C(C)C([C@@]([C@@]2(CCC1)[H])(C)[H])=O)C
SPLASH splash10-0a59-5900000000-a453014c0f513fa0ee45
Source of Spectrum QE-5-1472-9
Wiley ID 844230