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Bicyclo[2.2.2]octane-2,6-dione

View entire compound with spectra: 2 MS (GC)

Bicyclo[2.2.2]octane-2,6-dione
SpectraBase Compound ID 89Mmq7d3Pnf
InChI InChI=1S/C8H10O2/c9-7-3-5-1-2-6(7)8(10)4-5/h5-6H,1-4H2/t5-,6+
InChIKey VXBMHPUAHFEJAV-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 2Wz4j4SdXLN
Name Bicyclo[2.2.2]octane-2,6-dione
CAS Registry Number 38231-60-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H10O2
InChI InChI=1S/C8H10O2/c9-7-3-5-1-2-6(7)8(10)4-5/h5-6H,1-4H2/t5-,6+
InChIKey VXBMHPUAHFEJAV-OLQVQODUSA-N
Molecular Weight 138.166 g/mol
SMILES C1C([C@]2(C(C[C@@]1(CC2)[H])=O)[H])=O
SPLASH splash10-0a4r-9200000000-18dc70d533fbcd1dcc31
Synonyms bicyclo[2.2.2]octane-3,5-dione bicyclo[2.2.2]octane-3,5-quinone
Wiley ID 1484543