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(3aR*,4R*,7R*,7aS*)-3a,4,7,7a-Tetrahydro-2-phenyl-4,7-ethanoisoindole-1,3,5-trione
SpectraBase Compound ID 52DkLnA8lT5
InChI InChI=1S/C16H15NO3/c18-12-8-9-6-7-11(12)14-13(9)15(19)17(16(14)20)10-4-2-1-3-5-10/h1-5,9,11,13-14H,6-8H2/t9-,11+,13+,14-/m1/s1
InChIKey PECICLJEGFTNJM-DGFQIJBJSA-N
Mol Weight 269.3 g/mol
Molecular Formula C16H15NO3
Exact Mass 269.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HMx1gLguxC8
Name (3aR*,4R*,7R*,7aS*)-3a,4,7,7a-Tetrahydro-2-phenyl-4,7-ethanoisoindole-1,3,5-trione
Alternate Name(s) (1R,2S,6R,7R)-4-phenyl-4-azatricyclo[5.2.2.0(2,6)]undecane-3,5,8-trione
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Formula C16H15NO3
InChI InChI=1S/C16H15NO3/c18-12-8-9-6-7-11(12)14-13(9)15(19)17(16(14)20)10-4-2-1-3-5-10/h1-5,9,11,13-14H,6-8H2/t9-,11+,13+,14-/m1/s1
InChIKey PECICLJEGFTNJM-DGFQIJBJSA-N
Molecular Weight 269.300 g/mol
SMILES C1(N(C([C@@]2([C@@]3(C(C[C@]([C@]12[H])(CC3)[H])=O)[H])[H])=O)c1ccccc1)=O
SPLASH splash10-00pi-9180000000-a14737b0332c9c15be8c
Source of Spectrum F-55-11461-13
Wiley ID 839419