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5-(4-Chlorophenyl)-6a-methyl-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3H,5H)-dione
SpectraBase Compound ID LU99qwFMwAC
InChI InChI=1S/C12H10ClN3O2/c1-12-9(6-14-15-12)10(17)16(11(12)18)8-4-2-7(13)3-5-8/h2-5,9H,6H2,1H3
InChIKey UPFHSTGIAATRGR-UHFFFAOYSA-N
Mol Weight 263.68 g/mol
Molecular Formula C12H10ClN3O2
Exact Mass 263.046154 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JKAgL5s2SAx
Name 5-(4-Chlorophenyl)-6a-methyl-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3H,5H)-dione
Alternate Name(s) 5-(4-Chlorophenyl)-6a-methyl-3,3a-dihydropyrrolo[3,4-c]pyrazole-4,6-dione 5-(4-Chlorophenyl)-6a-methyl-3,3a-dihydropyrrolo[3,4-c]pyrazole-4,6-quinone Pyrrolo[3,4-c]pyrazole-4,6(3H,5H)-dione, 5-(4-chlorophenyl)-3a,6a-dihydro-6a-methyl-
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Formula C12H10ClN3O2
InChI InChI=1S/C12H10ClN3O2/c1-12-9(6-14-15-12)10(17)16(11(12)18)8-4-2-7(13)3-5-8/h2-5,9H,6H2,1H3
InChIKey UPFHSTGIAATRGR-UHFFFAOYSA-N
Molecular Weight 263.684 g/mol
SMILES C12(C(N(c3ccc(cc3)Cl)C(C1CN=N2)=O)=O)C
SPLASH splash10-0f80-9310000000-49ff3e4c687d803aeefa
Wiley ID 1449492