For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

3-(p-Tolyl)-5-trifluoromethyl-3,4-diazatetracyclo[7.3.1.1(7,11).0(2,6)]tetradeca-2(6),4-diene

View entire compound with spectra: 1 MS (GC)

3-(p-Tolyl)-5-trifluoromethyl-3,4-diazatetracyclo[7.3.1.1(7,11).0(2,6)]tetradeca-2(6),4-diene
SpectraBase Compound ID 4qBf3bnY8Py
InChI InChI=1S/C20H21F3N2/c1-11-2-4-16(5-3-11)25-18-15-9-12-6-13(10-15)8-14(7-12)17(18)19(24-25)20(21,22)23/h2-5,12-15H,6-10H2,1H3/t12-,13+,14-,15+
InChIKey DPZNOHXECYCIKB-NMWPEEMBSA-N
Mol Weight 346.4 g/mol
Molecular Formula C20H21F3N2
Exact Mass 346.165683 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9dqEd85f2QU
Name 3-(p-Tolyl)-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 C20H21F3N2
InChI InChI=1S/C20H21F3N2/c1-11-2-4-16(5-3-11)25-18-15-9-12-6-13(10-15)8-14(7-12)17(18)19(24-25)20(21,22)23/h2-5,12-15H,6-10H2,1H3/t12-,13+,14-,15+
InChIKey DPZNOHXECYCIKB-NMWPEEMBSA-N
Molecular Weight 346.397 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)C)[H]
SPLASH splash10-0002-0009000000-fc4ae1249796b8fcbe30
Source of Spectrum SO-0-1460-8
Synonyms 3-(4-Methylphenyl)-5-(trifluoromethyl)-3,4-diazatetracyclo[7.3.1.1(7,11).0(2,6)]tetradeca-2(6),4-diene
Wiley ID 1545412