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7,7-dibromo-1-[5-(7,7-dibromonorcaran-1-yl)-1-methylene-hex-5-enyl]norcarane
SpectraBase Compound ID GKV0TuctyZg
InChI InChI=1S/C21H28Br4/c1-14(18-12-5-3-10-16(18)20(18,22)23)8-7-9-15(2)19-13-6-4-11-17(19)21(19,24)25/h16-17H,1-13H2
InChIKey COBWQMYVCDPUIF-UHFFFAOYSA-N
Mol Weight 600.07 g/mol
Molecular Formula C21H28Br4
Exact Mass 595.892453 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JIa2wipHiqf
Name 7,7-dibromo-1-[5-(7,7-dibromonorcaran-1-yl)-1-methylene-hex-5-enyl]norcarane
Appearance Colorless semisolid
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Exact Mass 595.892452902 u
Formula C21H28Br4
InChI InChI=1S/C21H28Br4/c1-14(18-12-5-3-10-16(18)20(18,22)23)8-7-9-15(2)19-13-6-4-11-17(19)21(19,24)25/h16-17H,1-13H2
InChIKey COBWQMYVCDPUIF-UHFFFAOYSA-N
Instrument Name Thermo Finnigan TSQ 700
Ionization Type EI
Literature Reference DOI 10.1002/chem.201804497
Quality 290
Reported Formula C21H32NBr2(81)Br2
SMILES C12(CCCCC2C1(Br)Br)C(CCCC(C12CCCCC2C1(Br)Br)=C)=C
SPLASH splash10-004i-3790000000-036e95f7d01817470d7d
Sample Comments dr = 25.0:4.8:1
Source of Spectrum QE-24-SM12-S12c (DOI: 10.1002/chem.201804497)
Thin-Layer Chromatography 0.4 (n-pentane)
Wiley ID 1901811