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2,3-Dibromo-5-[4(a)-(hydroxymethyl)cyclohex-(e)-yl]-6-(trifluoromethyl)-1,4-dihydroxybenzene
SpectraBase Compound ID Bl3SjT6JVD3
InChI InChI=1S/C14H15Br2F3O3/c15-10-11(16)13(22)9(14(17,18)19)8(12(10)21)7-3-1-6(5-20)2-4-7/h6-7,20-22H,1-5H2
InChIKey RMPIFDSEENCAAV-UHFFFAOYSA-N
Mol Weight 448.07 g/mol
Molecular Formula C14H15Br2F3O3
Exact Mass 445.934005 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CH7b5SVvQx5
Name 2,3-Dibromo-5-[4(a)-(hydroxymethyl)cyclohex-(e)-yl]-6-(trifluoromethyl)-1,4-dihydroxybenzene
Alternate Name(s) 2,3-Dibromo-5-[4-(hydroxymethyl)cyclohexyl]-6-(trifluoromethyl)-1,4-benzenediol 2,3-Dibromo-5-[4-(hydroxymethyl)cyclohexyl]-6-(trifluoromethyl)benzene-1,4-diol 2,3-bis(bromanyl)-5-[4-(hydroxymethyl)cyclohexyl]-6-(trifluoromethyl)benzene-1,4-diol
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Formula C14H15Br2F3O3
InChI InChI=1S/C14H15Br2F3O3/c15-10-11(16)13(22)9(14(17,18)19)8(12(10)21)7-3-1-6(5-20)2-4-7/h6-7,20-22H,1-5H2
InChIKey RMPIFDSEENCAAV-UHFFFAOYSA-N
Molecular Weight 448.074 g/mol
SMILES Oc1c(c(c(c(c1C1CCC(CO)CC1)C(F)(F)F)O)Br)Br
SPLASH splash10-001i-0002900000-2268d9c5982556897c2c
Source of Spectrum J-62-8676-24
Wiley ID 1386445