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3-Phenyl-5-trifluoromethyl-3,4-diazatetracyclo[7.3.1.1(7,11).0(2,6)]tetradeca-2(6),4-diene
SpectraBase Compound ID LkATLzzISMj
InChI InChI=1S/C19H19F3N2/c20-19(21,22)18-16-13-7-11-6-12(8-13)10-14(9-11)17(16)24(23-18)15-4-2-1-3-5-15/h1-5,11-14H,6-10H2/t11-,12+,13-,14+
InChIKey XPCYRWOKJUQHFV-UHFFFAOYSA-N
Mol Weight 332.37 g/mol
Molecular Formula C19H19F3N2
Exact Mass 332.150033 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1raaEQmPTKG
Name 3-Phenyl-5-trifluoromethyl-3,4-diazatetracyclo[7.3.1.1(7,11).0(2,6)]tetradeca-2(6),4-diene
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H19F3N2
InChI InChI=1S/C19H19F3N2/c20-19(21,22)18-16-13-7-11-6-12(8-13)10-14(9-11)17(16)24(23-18)15-4-2-1-3-5-15/h1-5,11-14H,6-10H2/t11-,12+,13-,14+
InChIKey XPCYRWOKJUQHFV-UHFFFAOYSA-N
Molecular Weight 332.370 g/mol
SMILES [C@]12(c3[n](nc(c3[C@@]3(C[C@@](C[C@](C1)(C3)[H])(C2)[H])[H])C(F)(F)F)-c1ccccc1)[H]
SPLASH splash10-001i-0039000000-bc580e60147c54387575
Source of Spectrum SO-0-1460-8
Wiley ID 1545413