Systematic / IUPAC Name: Dimethyl 4-methyl-5-phenyl-1H-pyrrole-2,3-dicarboxylate
ID: Reference3569
Other Names:
2,3-Dimethyl 4-methyl-5-phenyl-1H-pyrrole-2,3-dicarboxylate;
1H-Pyrrole-2,3-dicarboxylic acid, 4-methyl-5-phenyl-, dimethyl ester
Formula: C15H15NO4
Dimethyl 4-methyl-5-phenyl-1H-pyrrole-2,3-dicarboxylate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Elite; Q Exactive Orbitrap |
No. of Spectral Trees | 3 |
No. of Spectra | 300 |
Tandem Spectra | MS1, MS2 |
Ionization Methods | ESI; NSI |
Analyzers | FT |
Last Modification | 1/13/2016 1:18:00 PM |
InChI | InChI=1S/C15H15NO4/c1-9-11(14(17)19-2)13(15(18)20-3)16-12(9)10-7-5-4-6-8-10/h4-8,16H,1-3H3 |
InChI Key | BZCPKPBIHMGDDM-UHFFFAOYSA-N |
Canonical SMILES | CC1=C(NC(=C1C(=O)OC)C(=O)OC)C2=CC=CC=C2 |
CAS | |
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Other Names |
2,3-Dimethyl 4-methyl-5-phenyl-1H-pyrrole-2,3-dicarboxylate; 1H-Pyrrole-2,3-dicarboxylic acid, 4-methyl-5-phenyl-, dimethyl ester |