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3-(3-Isopropyl-1H-indazol-1-yl)-4-methyl-1-phenyl-1H-pyrrole- 2,5-dione
SpectraBase Compound ID 6G4sCn9exzT
InChI InChI=1S/C21H19N3O2/c1-13(2)18-16-11-7-8-12-17(16)24(22-18)19-14(3)20(25)23(21(19)26)15-9-5-4-6-10-15/h4-13H,1-3H3
InChIKey GEVGHGLPVGTRKP-UHFFFAOYSA-N
Mol Weight 345.4 g/mol
Molecular Formula C21H19N3O2
Exact Mass 345.147727 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GsD0lmc2o2N
Name 3-(3-Isopropyl-1H-indazol-1-yl)-4-methyl-1-phenyl-1H-pyrrole-2,5-dione
Appearance Intense yellow solid
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Exact Mass 345.147726862 u
Formula C21H19N3O2
InChI InChI=1S/C21H19N3O2/c1-13(2)18-16-11-7-8-12-17(16)24(22-18)19-14(3)20(25)23(21(19)26)15-9-5-4-6-10-15/h4-13H,1-3H3
InChIKey GEVGHGLPVGTRKP-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1021/jo302463q
Molecular Weight 345.402 g/mol
Quality 121
Reported Formula C21H19N3O2
SMILES C12=CC=CC=C2N(N=C1C(C)C)C=1C(N(C(C1C)=O)C1=CC=CC=C1)=O
SPLASH splash10-05g0-0900000000-334c6553491fccd45f5e
Source of Spectrum JOC-78-635-18f (DOI: 10.1021/jo302463q)
Wiley ID 1911719