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3-Benzoyl-5-hydroxy-5-trifluoromethyl-3,4-diazatetracyclo[7.3.1.1(7,11).0(2,6)]tetradeca-2(6)-ene
SpectraBase Compound ID 9HhESEwP6Sq
InChI InChI=1S/C20H21F3N2O2/c21-20(22,23)19(27)16-14-7-11-6-12(8-14)10-15(9-11)17(16)25(24-19)18(26)13-4-2-1-3-5-13/h1-5,11-12,14-15,24,27H,6-10H2/t11-,12+,14-,15+,19?
InChIKey YDCHKOJNUQAKFS-LYDDSFSTSA-N
Mol Weight 378.4 g/mol
Molecular Formula C20H21F3N2O2
Exact Mass 378.155512 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Td17z4gvG1
Name 3-Benzoyl-5-hydroxy-5-trifluoromethyl-3,4-diazatetracyclo[7.3.1.1(7,11).0(2,6)]tetradeca-2(6)-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21F3N2O2
InChI InChI=1S/C20H21F3N2O2/c21-20(22,23)19(27)16-14-7-11-6-12(8-14)10-15(9-11)17(16)25(24-19)18(26)13-4-2-1-3-5-13/h1-5,11-12,14-15,24,27H,6-10H2/t11-,12+,14-,15+,19?
InChIKey YDCHKOJNUQAKFS-LYDDSFSTSA-N
Molecular Weight 378.395 g/mol
SMILES N1C(C2=C([C@]3(C[C@]4(C[C@](C[C@]2(C4)[H])(C3)[H])[H])[H])N1C(c1ccccc1)=O)(C(F)(F)F)O
SPLASH splash10-056r-0009000000-d758715fcfebd57190a2
Source of Spectrum SO-0-1460-10
Synonyms 3-Benzoyl-5-(trifluoromethyl)-3,4-diazatetracyclo[7.3.1.1(7,11).0(2,6)]tetradec-2(6)-en-5-ol
Wiley ID 1545407