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Methyl 8,8-dimethyl-6-phenyl-4,4a,5,7,7a,8-hexahydrothieno[2,3-e]isoindole-5,7-dione-2-carboxylate
SpectraBase Compound ID EkohP835FCi
InChI InChI=1S/C20H19NO4S/c1-3-25-20(24)14-10-12-9-13-16(19(23)21(2)18(13)22)15(17(12)26-14)11-7-5-4-6-8-11/h4-8,10,13,15-16H,3,9H2,1-2H3
InChIKey ZPUWOERXLCBIJX-UHFFFAOYSA-N
Mol Weight 369.44 g/mol
Molecular Formula C20H19NO4S
Exact Mass 369.103479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7KXigHxcSOd
Name Methyl 8,8-dimethyl-6-phenyl-4,4a,5,7,7a,8-hexahydrothieno[2,3-e]isoindole-5,7-dione-2-carboxylate
Alternate Name(s) 6-Methyl-5,7-dioxo-8-phenyl-4a,5,6,7,7a,8-hexahydro-4H-thieno[2,3-f]isoindole-2-carboxylic acid ethyl ester
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Formula C20H19NO4S
InChI InChI=1S/C20H19NO4S/c1-3-25-20(24)14-10-12-9-13-16(19(23)21(2)18(13)22)15(17(12)26-14)11-7-5-4-6-8-11/h4-8,10,13,15-16H,3,9H2,1-2H3
InChIKey ZPUWOERXLCBIJX-UHFFFAOYSA-N
Molecular Weight 369.435 g/mol
SMILES c12c(cc(s2)C(=O)OCC)CC2C(=O)N(C(C2C1c1ccccc1)=O)C
SPLASH splash10-0pvj-3639000000-1c84706dd380bc2c18c2
Source of Spectrum F-48-8114-25
Wiley ID 1353616