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Tricyclo[5.2.1.0 2,6]decan-8-one
SpectraBase Compound ID 444USEcY0Q9
InChI InChI=1S/C7H12O.C3H8/c8-7-4-5-1-2-6(7)3-5;1-3-2/h5-8H,1-4H2;3H2,1-2H3/t5-,6+,7-;/m1./s1
InChIKey JHVUZEVOBBLTBO-FNCXLRSCSA-N
Mol Weight 156.27 g/mol
Molecular Formula C10H20O
Exact Mass 156.151415 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H2TZDT5qyBH
Name Tricyclo[5.2.1.0 2,6]decan-8-one
Comments Computed using HOSE algorithm
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Exact Mass 156.151415263 u
Formula C10H20O
InChI InChI=1S/C7H12O.C3H8/c8-7-4-5-1-2-6(7)3-5;1-3-2/h5-8H,1-4H2;3H2,1-2H3/t5-,6+,7-;/m1./s1
InChIKey JHVUZEVOBBLTBO-FNCXLRSCSA-N
Molecular Weight 156.269 g/mol
Nominal Mass 156 u
SMILES CCC.O[C@@]1(C[C@@]2(CC[C@]1(C2)[H])[H])[H]