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4-(5-Bromo-2-fluorophenyl)-1-(4-bromonaphthalen-1-yl)-3-(trifluoromethyl)-1,4-dihydropyridazine
SpectraBase Compound ID 5PgqaloCQaB
InChI InChI=1S/C21H12Br2F4N2/c22-12-5-7-18(24)16(11-12)15-9-10-29(28-20(15)21(25,26)27)19-8-6-17(23)13-3-1-2-4-14(13)19/h1-11,15H
InChIKey AMTWGJNFKWNETI-UHFFFAOYSA-N
Mol Weight 528.14 g/mol
Molecular Formula C21H12Br2F4N2
Exact Mass 525.930337 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GeFKcCluL94
Name 4-(5-Bromo-2-fluorophenyl)-1-(4-bromonaphthalen-1-yl)-3-(trifluoromethyl)-1,4-dihydropyridazine
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Formula C21H12Br2F4N2
InChI InChI=1S/C21H12Br2F4N2/c22-12-5-7-18(24)16(11-12)15-9-10-29(28-20(15)21(25,26)27)19-8-6-17(23)13-3-1-2-4-14(13)19/h1-11,15H
InChIKey AMTWGJNFKWNETI-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201301638
Molecular Weight 528.143 g/mol
SMILES c1(N2N=C(C(C=C2)c2c(ccc(c2)Br)F)C(F)(F)F)ccc(c2c1cccc2)Br
SPLASH splash10-0400-0200090000-be3861ccd9a1e2f5ce3c
Source of Spectrum ACI-52-SM5-4k
Wiley ID 1781324