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(2E,9E)-6,7-DIBROMO-2,9-HUMURADIEN-8-ONE;DOMINANT-ISOMER
SpectraBase Compound ID IgiA5eJPHK3
InChI InChI=1S/C15H22Br2O/c1-11-5-6-12(16)15(4,17)13(18)8-10-14(2,3)9-7-11/h7-8,10,12H,5-6,9H2,1-4H3/b10-8+,11-7+
InChIKey RPVBCYODWHINTB-VTTRTIMMSA-N
Mol Weight 378.15 g/mol
Molecular Formula C15H22Br2O
Exact Mass 376.003741 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FLjovnYCxZ7
Name (2E,9E)-6,7-DIBROMO-2,9-HUMURADIEN-8-ONE;DOMINANT-ISOMER
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H22Br2O
InChI InChI=1S/C15H22Br2O/c1-11-5-6-12(16)15(4,17)13(18)8-10-14(2,3)9-7-11/h7-8,10,12H,5-6,9H2,1-4H3/b10-8+,11-7+
InChIKey RPVBCYODWHINTB-VTTRTIMMSA-N
Literature Reference Author T.KITAYAMA,T.OKAMOTO,R.K.HILL,Y.KAWAI,S.TAKAHASHI,S.YONEMORI ,Y.YAMAMOTO,K.OHE,S.
Literature Reference Citation J.ORG.CHEM.,64,2667(1999)
Literature Reference DOI 10.1021/jo981593n
Molecular Weight 378.147 g/mol
Sample ID 58614
Solvent DMSO-D6