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3-(m-Nitrophenyl)-5-trifluoromethyl-3,4-diazatetracyclo[7.3.1.1(7,11).0(2,6)]tetradeca-2(6),4-diene
SpectraBase Compound ID JVTz057XnDU
InChI InChI=1S/C19H18F3N3O2/c20-19(21,22)18-16-12-5-10-4-11(6-12)8-13(7-10)17(16)24(23-18)14-2-1-3-15(9-14)25(26)27/h1-3,9-13H,4-8H2/t10-,11+,12-,13+
InChIKey CORPJLCXMAUQAM-MPZDIEGVSA-N
Mol Weight 377.37 g/mol
Molecular Formula C19H18F3N3O2
Exact Mass 377.135111 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6HU28ZbgozI
Name 3-(m-Nitrophenyl)-5-trifluoromethyl-3,4-diazatetracyclo[7.3.1.1(7,11).0(2,6)]tetradeca-2(6),4-diene
Alternate Name(s) 3-(3-nitrophenyl)-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 C19H18F3N3O2
InChI InChI=1S/C19H18F3N3O2/c20-19(21,22)18-16-12-5-10-4-11(6-12)8-13(7-10)17(16)24(23-18)14-2-1-3-15(9-14)25(26)27/h1-3,9-13H,4-8H2/t10-,11+,12-,13+
InChIKey CORPJLCXMAUQAM-MPZDIEGVSA-N
Molecular Weight 377.367 g/mol
SMILES c1(c2c([C@]3(C[C@]4(C[C@@]2(C[C@](C4)(C3)[H])[H])[H])[H])[n](n1)-c1cc(N(=O)=O)ccc1)C(F)(F)F
SPLASH splash10-004i-0009000000-53b89c3c38e14a463206
Source of Spectrum SO-0-1460-8
Wiley ID 1545409