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1,4-(bis(trifluoromethyl)-7,12-methanocyclodeca[d]pyridazine
SpectraBase Compound ID JYdFU9E55uW
InChI InChI=1S/C15H8F6N2/c16-14(17,18)12-10-6-5-8-3-1-2-4-9(7-8)11(10)13(23-22-12)15(19,20)21/h1-6H,7H2
InChIKey WKXNHWHDBMSDJS-UHFFFAOYSA-N
Mol Weight 330.23 g/mol
Molecular Formula C15H8F6N2
Exact Mass 330.059167 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 93VlhkALuNy
Name 1,4-(bis(trifluoromethyl)-7,12-methanocyclodeca[d]pyridazine
CAS Registry Number 118832-08-9
Comments Less than 3 mono-isotopic peaks
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Formula C15H8F6N2
InChI InChI=1S/C15H8F6N2/c16-14(17,18)12-10-6-5-8-3-1-2-4-9(7-8)11(10)13(23-22-12)15(19,20)21/h1-6H,7H2
InChIKey WKXNHWHDBMSDJS-UHFFFAOYSA-N
Molecular Weight 330.233 g/mol
SMILES c1(c2c(C=3CC(C=C2)=CC=CC3)c(nn1)C(F)(F)F)C(F)(F)F
SPLASH splash10-0a59-9006000000-604141508d244acb2eca
Source of Spectrum K-122-713-17
Synonyms 3,6-bis(trifluoromethyl)-4,5-diazatricyclo[8.4.1.0(2,7)]pentadeca-1(14),2,4,6,8,10,12-heptaene
Wiley ID 1327517