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1-O-benzyl 5-O-ethyl 2-(4-methylanilino)imidazole-1,5-dicarboxylate
SpectraBase Compound ID 1Aeu618R9CW
InChI InChI=1S/C21H21N3O4/c1-3-27-19(25)18-13-22-20(23-17-11-9-15(2)10-12-17)24(18)21(26)28-14-16-7-5-4-6-8-16/h4-13H,3,14H2,1-2H3,(H,22,23)
InChIKey SIUILCHGKDFRRN-UHFFFAOYSA-N
Mol Weight 379.42 g/mol
Molecular Formula C21H21N3O4
Exact Mass 379.153206 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IW6fK72lFKC
Name 1-O-benzyl 5-O-ethyl 2-(4-methylanilino)imidazole-1,5-dicarboxylate
Alternate Name(s) 2-(4-Methylanilino)imidazole-1,5-dicarboxylic acid O5-ethyl ester O1-(phenylmethyl) ester 2-(p-toluidino)imidazole-1,5-dicarboxylic acid O1-benzyl ester O5-ethyl ester O1-benzyl O5-ethyl 2-(4-methylanilino)imidazole-1,5-dicarboxylate O5-ethyl O1-(phenylmethyl) 2-[(4-methylphenyl)amino]imidazole-1,5-dicarboxylate
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Formula C21H21N3O4
InChI InChI=1S/C21H21N3O4/c1-3-27-19(25)18-13-22-20(23-17-11-9-15(2)10-12-17)24(18)21(26)28-14-16-7-5-4-6-8-16/h4-13H,3,14H2,1-2H3,(H,22,23)
InChIKey SIUILCHGKDFRRN-UHFFFAOYSA-N
Molecular Weight 379.416 g/mol
SMILES N(c1[n](c(cn1)C(=O)OCC)C(OCc1ccccc1)=O)c1ccc(cc1)C
SPLASH splash10-0006-9473000000-b7bde31fce917b6d0c6f
Source of Spectrum SO-0-1460-4
Wiley ID 874194