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3,6-Methano-2H-cyclobut[a]inden-2-one, 1,1-dibromo-1,2a,2b,3,6,6a,7,7a-octahydro-, (2a.alpha.,2b.beta.,3.beta.,6.beta.,6a.beta.,7a.alpha.)-
SpectraBase Compound ID F2NSXqYS3Gk
InChI InChI=1S/C12H12Br2O/c13-12(14)8-4-7-5-1-2-6(3-5)9(7)10(8)11(12)15/h1-2,5-10H,3-4H2/t5-,6+,7-,8+,9+,10+/m0/s1
InChIKey QDBDYDTXWRGLBN-HDBWYCHPSA-N
Mol Weight 332.04 g/mol
Molecular Formula C12H12Br2O
Exact Mass 329.925491 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BQESQgSdZG7
Name 3,6-Methano-2H-cyclobut[a]inden-2-one, 1,1-dibromo-1,2a,2b,3,6,6a,7,7a-octahydro-, (2a.alpha.,2b.beta.,3.beta.,6.beta.,6a.beta.,7a.alpha.)-
CAS Registry Number 68303-84-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12Br2O
InChI InChI=1S/C12H12Br2O/c13-12(14)8-4-7-5-1-2-6(3-5)9(7)10(8)11(12)15/h1-2,5-10H,3-4H2/t5-,6+,7-,8+,9+,10+/m0/s1
InChIKey QDBDYDTXWRGLBN-HDBWYCHPSA-N
Molecular Weight 332.035 g/mol
SMILES C1(C(=O)[C@@]2([C@]1(C[C@]1([C@]3(C=C[C@]([C@@]21[H])([H])C3)[H])[H])[H])[H])(Br)Br
SPLASH splash10-014i-9060000000-0f615b6e7a9c27d3b514
Source of Spectrum K-111-3269-0
Synonyms (1S,2S,3S,6R,8S,9R)-5,5-dibromotetracyclo[7.2.1.0(2,8).0(3,6)]dodec-10-en-4-one 5,5-Dibromotetracyclo(7.2.1.0*2,8.0*3,6)dodec-10-en-4-one
Wiley ID 1327419