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1-(4-methoxybenzyl)-2-phenyl-4-Trifluoromethyl-3,5-dibromo-pyrrole
SpectraBase Compound ID CeUkB4fGo1Z
InChI InChI=1S/C19H14Br2F3NO/c1-26-14-9-7-12(8-10-14)11-25-17(13-5-3-2-4-6-13)16(20)15(18(25)21)19(22,23)24/h2-10H,11H2,1H3
InChIKey NUHWBJHPDNDCBC-UHFFFAOYSA-N
Mol Weight 489.13 g/mol
Molecular Formula C19H14Br2F3NO
Exact Mass 486.939425 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Nfq7dEs4UO
Name 1-(4-methoxybenzyl)-2-phenyl-4-Trifluoromethyl-3,5-dibromo-pyrrole
Appearance White solid
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Formula C19H14Br2F3NO
InChI InChI=1S/C19H14Br2F3NO/c1-26-14-9-7-12(8-10-14)11-25-17(13-5-3-2-4-6-13)16(20)15(18(25)21)19(22,23)24/h2-10H,11H2,1H3
InChIKey NUHWBJHPDNDCBC-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 489.130 g/mol
Reported Formula C19H14Br2F3NO
SMILES c1([n](c(c(c1C(F)(F)F)Br)-c1ccccc1)Cc1ccc(cc1)OC)Br
SPLASH splash10-00di-0900000000-eba58acff4efff3bc4ef
Source of Spectrum CN108047114A
Wiley ID 1870538