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cis,exo-1,2,3,4,4a,13b-Hexahydro-1,4-methano-7-fluoro-9H-tribenzo[b,f]azepine
SpectraBase Compound ID GD0fzYjWftl
InChI InChI=1S/C19H18FN/c20-13-7-8-15-17(10-13)21-16-4-2-1-3-14(16)18-11-5-6-12(9-11)19(15)18/h1-4,7-8,10-12,18-19,21H,5-6,9H2/t11-,12+,18-,19+/m1/s1
InChIKey VOWGNDGXSIRRKD-CUWOSUSNSA-N
Mol Weight 279.36 g/mol
Molecular Formula C19H18FN
Exact Mass 279.142328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EAEvicd6U0d
Name cis,exo-1,2,3,4,4a,13b-Hexahydro-1,4-methano-7-fluoro-9H-tribenzo[b,f]azepine
Alternate Name(s) (1R,4S,4aR,13bS)-7-fluoro-2,3,4,4a,9,13b-hexahydro-1H-1,4-methanotribenzo[b,d,f]azepine
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Formula C19H18FN
InChI InChI=1S/C19H18FN/c20-13-7-8-15-17(10-13)21-16-4-2-1-3-14(16)18-11-5-6-12(9-11)19(15)18/h1-4,7-8,10-12,18-19,21H,5-6,9H2/t11-,12+,18-,19+/m1/s1
InChIKey VOWGNDGXSIRRKD-CUWOSUSNSA-N
Molecular Weight 279.358 g/mol
SMILES N1c2cc(ccc2[C@]2([C@@](c3ccccc13)([C@@]1(CC[C@]2(C1)[H])[H])[H])[H])F
SPLASH splash10-01r2-0490000000-706e4d0835d021dcfee6
Source of Spectrum CCC-10-SM12-3k
Wiley ID 1812696