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(1S,2R,3R,4S)-2-(4-Bromophenyl)-6-hydroxy-6-methyl-4-oxo-N,N'-diphenylcyclohexane-1,3-dicarboxamide
SpectraBase Compound ID DqSiM3gTPo9
InChI InChI=1S/C27H25BrN2O4/c1-27(34)16-21(31)23(25(32)29-19-8-4-2-5-9-19)22(17-12-14-18(28)15-13-17)24(27)26(33)30-20-10-6-3-7-11-20/h2-15,22-24,34H,16H2,1H3,(H,29,32)(H,30,33)/t22-,23+,24-,27-/m0/s1
InChIKey ZMBRDBFIQSYBJS-LAOBSVPGSA-N
Mol Weight 521.41 g/mol
Molecular Formula C27H25BrN2O4
Exact Mass 520.09977 g/mol
Enantiomer InChIKey ZMBRDBFIQSYBJS-JPYYHWIRSA-N
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Source of Spectrum QB-41-SM11-3d

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Wiley Registry of Mass Spectral Data 2023

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