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Trimethyl 1,5-diphenylpyrrole-2,3,4-tricarboxylate

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

Trimethyl 1,5-diphenylpyrrole-2,3,4-tricarboxylate
SpectraBase Compound ID 8gPONdRxV1D
InChI InChI=1S/C22H19NO6/c1-27-20(24)16-17(21(25)28-2)19(22(26)29-3)23(15-12-8-5-9-13-15)18(16)14-10-6-4-7-11-14/h4-13H,1-3H3
InChIKey TVUMTQONDGNAPZ-UHFFFAOYSA-N
Mol Weight 393.4 g/mol
Molecular Formula C22H19NO6
Exact Mass 393.121237 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4AGqPoRduQb
Name Trimethyl 1,5-diphenylpyrrole-2,3,4-tricarboxylate
Comments Computed using HOSE algorithm
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Exact Mass 393.121237330 u
Formula C22H19NO6
InChI InChI=1S/C22H19NO6/c1-27-20(24)16-17(21(25)28-2)19(22(26)29-3)23(15-12-8-5-9-13-15)18(16)14-10-6-4-7-11-14/h4-13H,1-3H3
InChIKey TVUMTQONDGNAPZ-UHFFFAOYSA-N
Molecular Weight 393.395 g/mol
SMILES C=1(N(C(=C(C1C(=O)OC)C(=O)OC)C=1C=CC=CC1)C=1C=CC=CC1)C(=O)OC