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(1R,8R,9R)-5-(2-Fluoro-phenyl)-8-isopropyl-10,10-dimethyl-6-aza-tricyclo[7.1.1.0*2,7*]undeca-2(7),3,5-triene
SpectraBase Compound ID 9msBSsnjgwY
InChI InChI=1S/C21H24FN/c1-12(2)19-16-11-15(21(16,3)4)13-9-10-18(23-20(13)19)14-7-5-6-8-17(14)22/h5-10,12,15-16,19H,11H2,1-4H3/t15-,16+,19+/m0/s1
InChIKey PWOBXUURZJRTIB-FRQCXROJSA-N
Mol Weight 309.43 g/mol
Molecular Formula C21H24FN
Exact Mass 309.189278 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Ukk8aygMa
Name (1R,8R,9R)-5-(2-Fluoro-phenyl)-8-isopropyl-10,10-dimethyl-6-aza-tricyclo[7.1.1.0*2,7*]undeca-2(7),3,5-triene
Alternate Name(s) (7R,8S,10S)-(+)-2-(2'-Fluorophenyl)-7-isopropyl-11,11-dimethyl-1-azatricyclo[7.1.1.0(5,6)]undec-2,4,6-triene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24FN
InChI InChI=1S/C21H24FN/c1-12(2)19-16-11-15(21(16,3)4)13-9-10-18(23-20(13)19)14-7-5-6-8-17(14)22/h5-10,12,15-16,19H,11H2,1-4H3/t15-,16+,19+/m0/s1
InChIKey PWOBXUURZJRTIB-FRQCXROJSA-N
Molecular Weight 309.428 g/mol
SMILES c12nc(-c3c(F)cccc3)ccc2[C@@]2(C[C@]([C@]1(C(C)C)[H])(C2(C)C)[H])[H]
SPLASH splash10-00yi-3090000000-20a61ef12d902dc25f68
Source of Spectrum J-73-3999-12
Wiley ID 1668173