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(3aR,4S,7aR)-4-[(1S)-1-methyl-3-oxidanylidene-1H-isoindol-2-yl]-2-phenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione
SpectraBase Compound ID 8gMMz04PhSA
InChI InChI=1S/C23H20N2O3/c1-14-16-10-5-6-11-17(16)21(26)24(14)19-13-7-12-18-20(19)23(28)25(22(18)27)15-8-3-2-4-9-15/h2-11,13-14,18-20H,12H2,1H3/t14-,18+,19-,20+/m0/s1
InChIKey NWIYSJDYGWNCKV-WEFJBSGNSA-N
Mol Weight 372.42 g/mol
Molecular Formula C23H20N2O3
Exact Mass 372.147393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KJHzMT3qKz
Name (3aR,4S,7aR)-4-[(1S)-1-methyl-3-oxidanylidene-1H-isoindol-2-yl]-2-phenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione
Alternate Name(s) (3aR,4S,7aR)-4-[(1S)-1-methyl-3-oxo-1H-isoindol-2-yl]-2-phenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione (3aR,4S,7aR)-4-[(1S)-1-methyl-3-oxo-isoindolin-2-yl]-2-phenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione (3aR,4S,7aR)-4-[(3S)-1-keto-3-methyl-isoindolin-2-yl]-2-phenyl-3a,4,7,7a-tetrahydroisoindole-1,3-quinone
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Formula C23H20N2O3
InChI InChI=1S/C23H20N2O3/c1-14-16-10-5-6-11-17(16)21(26)24(14)19-13-7-12-18-20(19)23(28)25(22(18)27)15-8-3-2-4-9-15/h2-11,13-14,18-20H,12H2,1H3/t14-,18+,19-,20+/m0/s1
InChIKey NWIYSJDYGWNCKV-WEFJBSGNSA-N
Molecular Weight 372.424 g/mol
SMILES C1(N([C@](c2ccccc12)(C)[H])[C@@]1([C@@]2(C(N(c3ccccc3)C([C@@]2(CC=C1)[H])=O)=O)[H])[H])=O
SPLASH splash10-000t-5902000000-f8565207ae8bcc1fc249
Source of Spectrum K-2002-78-6
Wiley ID 1580595