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(2R,3S)-3-(4-Bromophenyl)-2-(4-chlorophenyl)cyclopropane-1,1,2-tricarbonitrile
SpectraBase Compound ID 4rxi0cxcOBs
InChI InChI=1S/C18H9BrClN3/c19-14-5-1-12(2-6-14)16-17(9-21,10-22)18(16,11-23)13-3-7-15(20)8-4-13/h1-8,16H/t16-,18-/m1/s1
InChIKey NGLQVVMBASDYKU-SJLPKXTDSA-N
Mol Weight 382.65 g/mol
Molecular Formula C18H9BrClN3
Exact Mass 380.966838 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3z3tWhLE2xQ
Name (2R,3S)-3-(4-Bromophenyl)-2-(4-chlorophenyl)cyclopropane-1,1,2-tricarbonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C18H9BrClN3
InChI InChI=1S/C18H9BrClN3/c19-14-5-1-12(2-6-14)16-17(9-21,10-22)18(16,11-23)13-3-7-15(20)8-4-13/h1-8,16H/t16-,18-/m1/s1
InChIKey NGLQVVMBASDYKU-SJLPKXTDSA-N
Molecular Weight 382.648 g/mol
SMILES C1([C@](C#N)(c2ccc(cc2)Cl)[C@@]1(c1ccc(cc1)Br)[H])(C#N)C#N
SPLASH splash10-001i-0009000000-5ca8d868ff5d78495683
Source of Spectrum U1-2010-1983-3b
Wiley ID 1663550