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2-Bromo-1-(6-ethylidene-2,2-dimethylcyclohexylmethyl)-3-methylbenzene
SpectraBase Compound ID DKyNLh1Allc
InChI InChI=1S/C18H25Br/c1-5-14-10-7-11-18(3,4)16(14)12-15-9-6-8-13(2)17(15)19/h5-6,8-9,16H,7,10-12H2,1-4H3/b14-5+
InChIKey QRFZZABIHXGILY-LHHJGKSTSA-N
Mol Weight 321.3 g/mol
Molecular Formula C18H25Br
Exact Mass 320.113964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EcMF6dP2gsQ
Name 2-Bromo-1-(6-ethylidene-2,2-dimethylcyclohexylmethyl)-3-methylbenzene
Comments Less than 3 mono-isotopic peaks
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Formula C18H25Br
InChI InChI=1S/C18H25Br/c1-5-14-10-7-11-18(3,4)16(14)12-15-9-6-8-13(2)17(15)19/h5-6,8-9,16H,7,10-12H2,1-4H3/b14-5+
InChIKey QRFZZABIHXGILY-LHHJGKSTSA-N
Molecular Weight 321.302 g/mol
SMILES C1(Cc2c(c(C)ccc2)Br)\C(=C\C)CCCC1(C)C
SPLASH splash10-00e9-0509000000-3e864e48ef5d6d1b41db
Source of Spectrum F4-0-1268-9
Synonyms 2-bromo-1-{[(6E)-6-ethylidene-2,2-dimethylcyclohexyl]methyl}-3-methylbenzene
Wiley ID 1619535