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Diethyl N-Tosyl-1,2,3,5,6,7,7a-octahydropyrrolo[3,4-c]pyridazin-1,2-dicarboxylate
SpectraBase Compound ID JLT4PptAtVJ
InChI InChI=1S/C19H25N3O6S/c1-4-27-18(23)21-11-10-15-12-20(13-17(15)22(21)19(24)28-5-2)29(25,26)16-8-6-14(3)7-9-16/h6-10,17H,4-5,11-13H2,1-3H3
InChIKey VRGDUEUXRIGBAJ-UHFFFAOYSA-N
Mol Weight 423.48 g/mol
Molecular Formula C19H25N3O6S
Exact Mass 423.146407 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CcKmynR44Kh
Name Diethyl N-Tosyl-1,2,3,5,6,7,7a-octahydropyrrolo[3,4-c]pyridazin-1,2-dicarboxylate
Alternate Name(s) 6-(4-Methylphenyl)sulfonyl-3,5,7,7a-tetrahydropyrrolo[3,4-c]pyridazine-1,2-dicarboxylic acid diethyl ester Diethyl 6-(p-tolylsulfonyl)-3,5,7,7a-tetrahydropyrrolo[3,4-c]pyridazine-1,2-dicarboxylate Diethyl 6-(4-methylphenyl)sulfonyl-3,5,7,7a-tetrahydropyrrolo[3,4-c]pyridazine-1,2-dicarboxylate
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Formula C19H25N3O6S
InChI InChI=1S/C19H25N3O6S/c1-4-27-18(23)21-11-10-15-12-20(13-17(15)22(21)19(24)28-5-2)29(25,26)16-8-6-14(3)7-9-16/h6-10,17H,4-5,11-13H2,1-3H3
InChIKey VRGDUEUXRIGBAJ-UHFFFAOYSA-N
Molecular Weight 423.484 g/mol
SMILES C1N(S(c2ccc(cc2)C)(=O)=O)CC2=CCN(N(C12)C(=O)OCC)C(=O)OCC
SPLASH splash10-00ke-4950000000-7cdb349c5976e7c95df7
Source of Spectrum SO-0-1771-5
Wiley ID 878239