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3-(p-Chlorophenyl)-5-trifluoromethyl-3,4-diazatetracyclo[7.3.1.1(7,11).0(2,6)]tetradeca-2(6),4-diene
SpectraBase Compound ID 3zIuOiN5Wsl
InChI InChI=1S/C19H18ClF3N2/c20-14-1-3-15(4-2-14)25-17-13-8-10-5-11(9-13)7-12(6-10)16(17)18(24-25)19(21,22)23/h1-4,10-13H,5-9H2/t10-,11+,12-,13+
InChIKey GQRMWBAGMGJALL-MPZDIEGVSA-N
Mol Weight 366.82 g/mol
Molecular Formula C19H18ClF3N2
Exact Mass 366.111061 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EY5b76tAcbw
Name 3-(p-Chlorophenyl)-5-trifluoromethyl-3,4-diazatetracyclo[7.3.1.1(7,11).0(2,6)]tetradeca-2(6),4-diene
Alternate Name(s) 3-(4-Chlorophenyl)-5-(trifluoromethyl)-3,4-diazatetracyclo[7.3.1.1(7,11).0(2,6)]tetradeca-2(6),4-diene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18ClF3N2
InChI InChI=1S/C19H18ClF3N2/c20-14-1-3-15(4-2-14)25-17-13-8-10-5-11(9-13)7-12(6-10)16(17)18(24-25)19(21,22)23/h1-4,10-13H,5-9H2/t10-,11+,12-,13+
InChIKey GQRMWBAGMGJALL-MPZDIEGVSA-N
Molecular Weight 366.815 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)-c1ccc(cc1)Cl)[H]
SPLASH splash10-00lr-0009000000-c5f43c26a05e6ced43f2
Source of Spectrum SO-0-1460-8
Wiley ID 1545411