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(3a.alpha.,4.alpha.,7.alpha.,7a.alpha.,8r)-3a,4,7,7a-Tetrahydo-8-iodo-2-phenyl-4,7-methano-1H-isoindole-1,3(2H)-dione
SpectraBase Compound ID AzjfvHJJyeX
InChI InChI=1S/C15H12INO2/c16-13-9-6-7-10(13)12-11(9)14(18)17(15(12)19)8-4-2-1-3-5-8/h1-7,9-13H/t9-,10+,11-,12+,13?
InChIKey PMSQWWDHBAXBGV-HTYKTIJTSA-N
Mol Weight 365.17 g/mol
Molecular Formula C15H12INO2
Exact Mass 364.991274 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6SzFbRC30b7
Name (3a.alpha.,4.alpha.,7.alpha.,7a.alpha.,8r)-3a,4,7,7a-Tetrahydo-8-iodo-2-phenyl-4,7-methano-1H-isoindole-1,3(2H)-dione
Alternate Name(s) (1R,2R,6S,7R)-10-iodo-4-phenyl-4-azatricyclo[5.2.1.0(2,6)]dec-8-ene-3,5-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12INO2
InChI InChI=1S/C15H12INO2/c16-13-9-6-7-10(13)12-11(9)14(18)17(15(12)19)8-4-2-1-3-5-8/h1-7,9-13H/t9-,10+,11-,12+,13?
InChIKey PMSQWWDHBAXBGV-HTYKTIJTSA-N
Molecular Weight 365.170 g/mol
SMILES C1(N(C([C@@]2([C@]3(C=C[C@@]([C@]12[H])(C3I)[H])[H])[H])=O)c1ccccc1)=O
SPLASH splash10-014l-9411000000-334867e8658696fd6800
Source of Spectrum J-62-945-49
Wiley ID 1351283