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2-[5-(1,2-Dimethyl-4-imidazolyl)-5-oxopentyl]isoindole-1,3-dione

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2-[5-(1,2-Dimethyl-4-imidazolyl)-5-oxopentyl]isoindole-1,3-dione
SpectraBase Compound ID HiF2klkCxmg
InChI InChI=1S/C18H19N3O3/c1-12-19-15(11-20(12)2)16(22)9-5-6-10-21-17(23)13-7-3-4-8-14(13)18(21)24/h3-4,7-8,11H,5-6,9-10H2,1-2H3
InChIKey JLGUKMFJYBVJQR-UHFFFAOYSA-N
Mol Weight 325.37 g/mol
Molecular Formula C18H19N3O3
Exact Mass 325.142641 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8D7QFJcthUt
Name 2-[5-(1,2-Dimethyl-4-imidazolyl)-5-oxopentyl]isoindole-1,3-dione
Comments Computed using HOSE algorithm
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Exact Mass 325.142641481 u
Formula C18H19N3O3
InChI InChI=1S/C18H19N3O3/c1-12-19-15(11-20(12)2)16(22)9-5-6-10-21-17(23)13-7-3-4-8-14(13)18(21)24/h3-4,7-8,11H,5-6,9-10H2,1-2H3
InChIKey JLGUKMFJYBVJQR-UHFFFAOYSA-N
Molecular Weight 325.368 g/mol
SMILES C(CCCCN1C(=O)C=2C(C1=O)=CC=CC2)(=O)C=1N=C(N(C1)C)C