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1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine
SpectraBase Compound ID 8LVLKDH7Bt9
InChI InChI=1S/C17H13ClF6N4O2/c18-12-7-11(17(22,23)24)9-25-15(12)27-5-3-26(4-6-27)13-2-1-10(16(19,20)21)8-14(13)28(29)30/h1-2,7-9H,3-6H2
InChIKey FZDRPGIBMPULJF-UHFFFAOYSA-N
Mol Weight 454.76 g/mol
Molecular Formula C17H13ClF6N4O2
Exact Mass 454.063122 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E1xCzINuUd
Name 1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine
Alternate Name(s) 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine
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Formula C17H13ClF6N4O2
InChI InChI=1S/C17H13ClF6N4O2/c18-12-7-11(17(22,23)24)9-25-15(12)27-5-3-26(4-6-27)13-2-1-10(16(19,20)21)8-14(13)28(29)30/h1-2,7-9H,3-6H2
InChIKey FZDRPGIBMPULJF-UHFFFAOYSA-N
Molecular Weight 454.760 g/mol
SMILES c1(N(=O)=O)c(N2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)ccc(C(F)(F)F)c1
SPLASH splash10-05fs-0690000000-68de9b66002dd5c11349
Wiley ID 1464190