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1,4-Bis(trifluoromerthyl)cycloocta[d]pyridazine
SpectraBase Compound ID FXYd2F1KiLV
InChI InChI=1S/C12H8F6N2/c13-11(14,15)9-7-5-3-1-2-4-6-8(7)10(20-19-9)12(16,17)18/h1-7,20H/b2-1-,5-3-,6-4-
InChIKey ZXNBDNXCCMUWNO-XCADPSHZSA-N
Mol Weight 294.2 g/mol
Molecular Formula C12H8F6N2
Exact Mass 294.059167 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7rdTZOJ42PQ
Name 1,4-Bis(trifluoromerthyl)cycloocta[d]pyridazine
Alternate Name(s) 2,4a-Dihydro-1,4-bis(trifluoromethyl)cycloocta[d]pyridazine 1,4-bis(trifluoromethyl)-2,4a-dihydrocycloocta[d]pyridazine
Comments Less than 3 mono-isotopic peaks
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Formula C12H8F6N2
InChI InChI=1S/C12H8F6N2/c13-11(14,15)9-7-5-3-1-2-4-6-8(7)10(20-19-9)12(16,17)18/h1-7,20H/b2-1-,5-3-,6-4-
InChIKey ZXNBDNXCCMUWNO-XCADPSHZSA-N
Molecular Weight 294.200 g/mol
SMILES N1C(=C2C(C(=N1)C(F)(F)F)\C=C/C=C\C=C/2)C(F)(F)F
SPLASH splash10-014l-0090000000-f33b3a0f8592f0745df4
Source of Spectrum U-1995-664-6
Wiley ID 766587