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Tricyclo[5.1.0.0(1,3)]octan-5-one
SpectraBase Compound ID KzxX1rVqGKD
InChI InChI=1S/C8H10O/c9-7-1-5-3-8(5)4-6(8)2-7/h5-6H,1-4H2/t5-,6-,8?/m1/s1
InChIKey UVTBUSFOHSUDPH-LPBDRPKESA-N
Mol Weight 122.17 g/mol
Molecular Formula C8H10O
Exact Mass 122.073165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GAxZwIROA2P
Name Tricyclo[5.1.0.0(1,3)]octan-5-one
Alternate Name(s) (3S,7S)-Tricyclo[5.1.0.0(1,3)]octan-5-one
Comments Less than 3 mono-isotopic peaks
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Formula C8H10O
InChI InChI=1S/C8H10O/c9-7-1-5-3-8(5)4-6(8)2-7/h5-6H,1-4H2/t5-,6-,8?/m1/s1
InChIKey UVTBUSFOHSUDPH-LPBDRPKESA-N
Molecular Weight 122.167 g/mol
SMILES C123[C@@](CC(=O)C[C@]3([H])C1)([H])C2
SPLASH splash10-004i-9000000000-02aed75a7458d40098e8
Source of Spectrum J-63-1398-11
Wiley ID 1128168