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1-Benzyl-5-methyl-pyrrole-2,4-dicarboxylic acid dimethyl ester
SpectraBase Compound ID BmT24Ahff5s
InChI InChI=1S/C16H17NO4/c1-11-13(15(18)20-2)9-14(16(19)21-3)17(11)10-12-7-5-4-6-8-12/h4-9H,10H2,1-3H3
InChIKey XBIJXGGHFFTTCY-UHFFFAOYSA-N
Mol Weight 287.31 g/mol
Molecular Formula C16H17NO4
Exact Mass 287.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EeRlTK3eKoa
Name 1-Benzyl-5-methyl-pyrrole-2,4-dicarboxylic acid dimethyl ester
Alternate Name(s) 5-Methyl-1-(phenylmethyl)pyrrole-2,4-dicarboxylic acid dimethyl ester Dimethyl 1-benzyl-5-methyl-pyrrole-2,4-dicarboxylate Dimethyl 5-methyl-1-(phenylmethyl)pyrrole-2,4-dicarboxylate
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Formula C16H17NO4
InChI InChI=1S/C16H17NO4/c1-11-13(15(18)20-2)9-14(16(19)21-3)17(11)10-12-7-5-4-6-8-12/h4-9H,10H2,1-3H3
InChIKey XBIJXGGHFFTTCY-UHFFFAOYSA-N
Molecular Weight 287.315 g/mol
SMILES c1([n](c(c(c1)C(=O)OC)C)Cc1ccccc1)C(=O)OC
SPLASH splash10-000f-7090000000-21a1b10d4617b7436d4e
Source of Spectrum D1-2001-1442-3
Wiley ID 851244