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4,7,12-Tribromo[2.2] paracyclophane
SpectraBase Compound ID AdOE8Kolojt
InChI InChI=1S/C16H13Br3/c17-14-7-10-1-3-11(14)5-6-13-9-15(18)12(4-2-10)8-16(13)19/h1,3,7-9H,2,4-6H2
InChIKey GKZYMDNXSZDLQM-UHFFFAOYSA-N
Mol Weight 444.99 g/mol
Molecular Formula C16H13Br3
Exact Mass 441.856739 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6YBcXvItneX
Name 4,7,12-Tribromo[2.2] paracyclophane
Alternate Name(s) 4,12,15-Tribromo[2.2]paracyclophane 4,7,12-Tribromo[2.2]paracyclophane 5,11,13-Tribromo-tricyclo[8.2.2.2*4,7*]hexadeca-1(13),4(16),5,7(15),10(14),11-hexaene 5,11,13-tribromotricyclo[8.2.2.2(4,7)]hexadeca-1(12),4,6,10,13,15-hexaene
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Formula C16H13Br3
InChI InChI=1S/C16H13Br3/c17-14-7-10-1-3-11(14)5-6-13-9-15(18)12(4-2-10)8-16(13)19/h1,3,7-9H,2,4-6H2
InChIKey GKZYMDNXSZDLQM-UHFFFAOYSA-N
Molecular Weight 444.992 g/mol
SMILES c12c(cc(c(c2)Br)CCc2ccc(c(c2)Br)CC1)Br
SPLASH splash10-001i-0900200000-0cddcaa6399c518bbf89
Source of Spectrum K-126-1647-5
Wiley ID 1385177