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Bicyclo[2.2.2]octane-2,3-dione
SpectraBase Compound ID 2GPS36G4RcA
InChI InChI=1S/C8H10O2/c9-7-5-1-2-6(4-3-5)8(7)10/h5-6H,1-4H2/t5-,6+
InChIKey WJSSILYUTTWPSP-OLQVQODUSA-N
Mol Weight 138.17 g/mol
Molecular Formula C8H10O2
Exact Mass 138.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BSdadtZFA7F
Name Bicyclo[2.2.2]octane-2,3-dione
Alternate Name(s) bicyclo[2.2.2]octane-2,3-quinone
CAS Registry Number 4216-89-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H10O2
InChI InChI=1S/C8H10O2/c9-7-5-1-2-6(4-3-5)8(7)10/h5-6H,1-4H2/t5-,6+
InChIKey WJSSILYUTTWPSP-OLQVQODUSA-N
Molecular Weight 138.166 g/mol
SMILES C1(C([C@]2(CC[C@@]1(CC2)[H])[H])=O)=O
SPLASH splash10-0gbi-9100000000-023957d689e902b2ddbb
Source of Spectrum HE-1986-1063-0
Wiley ID 1137803