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3-Acetyl-5-trifluoromethyl-3,4-diazatetracyclo[7.3.1.1(7,11).0(2,6)]tetradeca-2(6),4-diene
SpectraBase Compound ID LgXgKQKRd4q
InChI InChI=1S/C15H17F3N2O/c1-7(21)20-13-11-5-8-2-9(6-11)4-10(3-8)12(13)14(19-20)15(16,17)18/h8-11H,2-6H2,1H3/t8-,9+,10-,11+
InChIKey DUMUTSLOLCEJFP-DTIDVZRVSA-N
Mol Weight 298.31 g/mol
Molecular Formula C15H17F3N2O
Exact Mass 298.129298 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HRlhtrgDhMN
Name 3-Acetyl-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 C15H17F3N2O
InChI InChI=1S/C15H17F3N2O/c1-7(21)20-13-11-5-8-2-9(6-11)4-10(3-8)12(13)14(19-20)15(16,17)18/h8-11H,2-6H2,1H3/t8-,9+,10-,11+
InChIKey DUMUTSLOLCEJFP-DTIDVZRVSA-N
Molecular Weight 298.309 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)C(=O)C)[H]
SPLASH splash10-0a4i-0090000000-1dca8ee0dd540bb31839
Source of Spectrum SO-0-1461-11
Wiley ID 1545404