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8,10-Dimethyl-7-(trifluoromethyl)-5,6,8,10-tetrahydro-8,10,11-triaza-cyclopenta[b]phenanthrene-9-thione
SpectraBase Compound ID CAFqBiJzK64
InChI InChI=1S/C17H14F3N3S/c1-22-14-12(17(18,19)20)11-8-7-9-5-3-4-6-10(9)13(11)21-15(14)23(2)16(22)24/h3-6H,7-8H2,1-2H3
InChIKey IUPCEFODYGSKKC-UHFFFAOYSA-N
Mol Weight 349.38 g/mol
Molecular Formula C17H14F3N3S
Exact Mass 349.086053 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hfn1zCvSDwg
Name 8,10-Dimethyl-7-(trifluoromethyl)-5,6,8,10-tetrahydro-8,10,11-triaza-cyclopenta[b]phenanthrene-9-thione
Comments Less than 3 mono-isotopic peaks
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Formula C17H14F3N3S
InChI InChI=1S/C17H14F3N3S/c1-22-14-12(17(18,19)20)11-8-7-9-5-3-4-6-10(9)13(11)21-15(14)23(2)16(22)24/h3-6H,7-8H2,1-2H3
InChIKey IUPCEFODYGSKKC-UHFFFAOYSA-N
Molecular Weight 349.375 g/mol
SMILES C1(N(c2nc-3c(c(c2N1C)C(F)(F)F)CCc1c3cccc1)C)=S
SPLASH splash10-0002-0009000000-619425da1e647ee86b20
Source of Spectrum F4-41-1873-31
Wiley ID 1672445