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(3R,3aS,6aR)-3-(4-chlorophenyl)-2-methyl-5-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d]isoxazole-4,6-dione
SpectraBase Compound ID KWulrLXz4Kx
InChI InChI=1S/C18H15ClN2O3/c1-20-15(11-7-9-12(19)10-8-11)14-16(24-20)18(23)21(17(14)22)13-5-3-2-4-6-13/h2-10,14-16H,1H3/t14-,15-,16+/m0/s1
InChIKey YSFOWBXCDOQDFR-HRCADAONSA-N
Mol Weight 342.78 g/mol
Molecular Formula C18H15ClN2O3
Exact Mass 342.07712 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4MMhYGL9uiv
Name (3R,3aS,6aR)-3-(4-chlorophenyl)-2-methyl-5-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d]isoxazole-4,6-dione
Alternate Name(s) (3R,3aS,6aR)-3-(4-chlorophenyl)-2-methyl-5-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione (3R,3aS,6aR)-3-(4-chlorophenyl)-2-methyl-5-phenyl-3a,6a-dihydro-3H-pyrrol[3,4-d]isoxazole-4,6-quinone
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Formula C18H15ClN2O3
InChI InChI=1S/C18H15ClN2O3/c1-20-15(11-7-9-12(19)10-8-11)14-16(24-20)18(23)21(17(14)22)13-5-3-2-4-6-13/h2-10,14-16H,1H3/t14-,15-,16+/m0/s1
InChIKey YSFOWBXCDOQDFR-HRCADAONSA-N
Molecular Weight 342.782 g/mol
SMILES [C@@]12([C@@](C(=O)N(C2=O)c2ccccc2)([C@@](c2ccc(cc2)Cl)([H])N(O1)C)[H])[H]
SPLASH splash10-014l-0905000000-df089931126dd443fc61
Source of Spectrum AJ-41-745-0
Wiley ID 1567653