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Dimethyl .alpha.-methyl-5-formyl-2-pyrrolemalonate
SpectraBase Compound ID HqZ0KSTXlh0
InChI InChI=1S/C13H17NO5/c1-4-18-11(16)13(3,12(17)19-5-2)10-7-6-9(8-15)14-10/h6-8,14H,4-5H2,1-3H3
InChIKey RMYFTLHSUBZMHE-UHFFFAOYSA-N
Mol Weight 267.28 g/mol
Molecular Formula C13H17NO5
Exact Mass 267.110673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 15H4b11564H
Name Dimethyl .alpha.-methyl-5-formyl-2-pyrrolemalonate
Alternate Name(s) Diethyl .alpha.-methyl-5-formyl-2-pyrrolemalonate 2-(5-formyl-1H-pyrrol-2-yl)-2-methylpropanedioic acid diethyl ester Diethyl 2-(5-formyl-1H-pyrrol-2-yl)-2-methylpropanedioate Diethyl 2-(5-formyl-1H-pyrrol-2-yl)-2-methyl-propanedioate Diethyl 2-(5-methanoyl-1H-pyrrol-2-yl)-2-methyl-propanedioate
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Formula C13H17NO5
InChI InChI=1S/C13H17NO5/c1-4-18-11(16)13(3,12(17)19-5-2)10-7-6-9(8-15)14-10/h6-8,14H,4-5H2,1-3H3
InChIKey RMYFTLHSUBZMHE-UHFFFAOYSA-N
Molecular Weight 267.281 g/mol
SMILES [nH]1c(ccc1C(C(=O)OCC)(C(=O)OCC)C)C=O
SPLASH splash10-00kg-2910000000-8ad98600a91e1b4b5702
Source of Spectrum J-58-7611-8
Wiley ID 1271061