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Tricyclo[5.1.0.0(3,5)]octane-2,6-dione, 4,8-dibromo-1,3,5,7-tetramethyl-, (1.alpha.,3.beta.,4.alpha.,5.beta.,7.alpha.,8.beta.)-
SpectraBase Compound ID CHVGue2ONcK
InChI InChI=1S/C12H14Br2O2/c1-9-5(13)10(9,2)8(16)12(4)6(14)11(12,3)7(9)15/h5-6H,1-4H3/t5-,6-,9-,10+,11-,12+
InChIKey HWDSMSDGFSHYRW-IODJOVOHSA-N
Mol Weight 350.05 g/mol
Molecular Formula C12H14Br2O2
Exact Mass 347.936056 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Y2eMvX8wC
Name Tricyclo[5.1.0.0(3,5)]octane-2,6-dione, 4,8-dibromo-1,3,5,7-tetramethyl-, (1.alpha.,3.beta.,4.alpha.,5.beta.,7.alpha.,8.beta.)-
CAS Registry Number 61605-40-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14Br2O2
InChI InChI=1S/C12H14Br2O2/c1-9-5(13)10(9,2)8(16)12(4)6(14)11(12,3)7(9)15/h5-6H,1-4H3/t5-,6-,9-,10+,11-,12+
InChIKey HWDSMSDGFSHYRW-IODJOVOHSA-N
Molecular Weight 350.050 g/mol
SMILES [C@]12([C@@](C(=O)[C@]3([C@@](C2=O)([C@]3(Br)[H])C)C)(C)[C@@]1(Br)[H])C
SPLASH splash10-0296-0930000000-36eb9d9a5d9f76cb0d7d
Source of Spectrum H-59-1325-15
Synonyms (1R,3R,5S,7S)-4,8-dibromo-1,3,5,7-tetramethyltricyclo[5.1.0.0(3,5)]octane-2,6-dione 4-endo,8-endo-dibromo-1,3,5,7-tetramethyl-anti-tricyclo[5.1.0.0(3,5)]octane-2,6-dione
Wiley ID 1340240