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1-benzyl-2-(4-fluorophenyl)4-trifluoromethyl-3,5-dibromo-pyrrole
SpectraBase Compound ID 8ocrpai3KWm
InChI InChI=1S/C18H11Br2F4N/c19-15-14(18(22,23)24)17(20)25(10-11-4-2-1-3-5-11)16(15)12-6-8-13(21)9-7-12/h1-9H,10H2
InChIKey BAUCNNLWLXANLM-UHFFFAOYSA-N
Mol Weight 477.09 g/mol
Molecular Formula C18H11Br2F4N
Exact Mass 474.919438 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KGbeatVlKJq
Name 1-benzyl-2-(4-fluorophenyl)4-trifluoromethyl-3,5-dibromo-pyrrole
Appearance White solid
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Formula C18H11Br2F4N
InChI InChI=1S/C18H11Br2F4N/c19-15-14(18(22,23)24)17(20)25(10-11-4-2-1-3-5-11)16(15)12-6-8-13(21)9-7-12/h1-9H,10H2
InChIKey BAUCNNLWLXANLM-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 477.095 g/mol
Reported Formula C18H11Br2F4N
SMILES c1([n](c(c(c1C(F)(F)F)Br)-c1ccc(cc1)F)Cc1ccccc1)Br
SPLASH splash10-0006-9000100000-33ed3095ce5de3b31c72
Source of Spectrum CN108047114A
Wiley ID 1870546