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(3aS*,8R*,8aS*,8bR*)-2,5-Diphenyl-3a,4,6,7,8a,8b-hexahydro-8-(2',2'-dichloromethylcarbonylamino)cyclopent[e]isoindole-1,3(2H,3aH)-dione
SpectraBase Compound ID GWTNA0onm8U
InChI InChI=1S/C25H22Cl2N2O3/c26-22(27)23(30)28-19-12-11-16-17(14-7-3-1-4-8-14)13-18-21(20(16)19)25(32)29(24(18)31)15-9-5-2-6-10-15/h1-10,18-22H,11-13H2,(H,28,30)/t18-,19+,20-,21-/m0/s1
InChIKey JMGLFWXNNAKURK-WOZUAGRISA-N
Mol Weight 469.37 g/mol
Molecular Formula C25H22Cl2N2O3
Exact Mass 468.100748 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IZc94SBVSOm
Name (3aS*,8R*,8aS*,8bR*)-2,5-Diphenyl-3a,4,6,7,8a,8b-hexahydro-8-(2',2'-dichloromethylcarbonylamino)cyclopent[e]isoindole-1,3(2H,3aH)-dione
Alternate Name(s) 2,2-Dichloro-N-((3aS,8R,8aS,8bR)-1,3-dioxo-2,5-diphenyl-1,2,3,3a,4,6,7,8,8a,8b-decahydrocyclopenta[e]isoindol-8-yl)acetamide
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Formula C25H22Cl2N2O3
InChI InChI=1S/C25H22Cl2N2O3/c26-22(27)23(30)28-19-12-11-16-17(14-7-3-1-4-8-14)13-18-21(20(16)19)25(32)29(24(18)31)15-9-5-2-6-10-15/h1-10,18-22H,11-13H2,(H,28,30)/t18-,19+,20-,21-/m0/s1
InChIKey JMGLFWXNNAKURK-WOZUAGRISA-N
Molecular Weight 469.368 g/mol
SMILES N([C@]1([C@@]2(C(=C(C[C@]3([C@@]2(C(N(C3=O)c2ccccc2)=O)[H])[H])c2ccccc2)CC1)[H])[H])C(C(Cl)Cl)=O
SPLASH splash10-0006-0907000000-a55fff36beef4c4cf1b6
Source of Spectrum F5-14-3295-38
Wiley ID 1804691