For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5-Ethoxycarbonylmethyl-3,4-dimethyl-1H-pyrrole-2-carboxylic acid, ethyl ester
SpectraBase Compound ID 6AgyGaOD2RR
InChI InChI=1S/C13H19NO4/c1-5-17-11(15)7-10-8(3)9(4)12(14-10)13(16)18-6-2/h14H,5-7H2,1-4H3
InChIKey BMLKCEMFIJTMRO-UHFFFAOYSA-N
Mol Weight 253.3 g/mol
Molecular Formula C13H19NO4
Exact Mass 253.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 3RIWqOnkJiO
Name 5-Ethoxycarbonylmethyl-3,4-dimethyl-1H-pyrrole-2-carboxylic acid, ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H19NO4
InChI InChI=1S/C13H19NO4/c1-5-17-11(15)7-10-8(3)9(4)12(14-10)13(16)18-6-2/h14H,5-7H2,1-4H3
InChIKey BMLKCEMFIJTMRO-UHFFFAOYSA-N
Molecular Weight 253.298 g/mol
SMILES [nH]1c(c(c(c1C(=O)OCC)C)C)CC(=O)OCC
SPLASH splash10-001i-2930000000-41de386c4bac5a1aeab5
Synonyms 5-(2-Ethoxy-2-keto-ethyl)-3,4-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester 5-(2-Ethoxy-2-oxoethyl)-3,4-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Ethyl 5-(2-ethoxy-2-oxidanylidene-ethyl)-3,4-dimethyl-1H-pyrrole-2-carboxylate Ethyl 5-(2-ethoxy-2-oxo-ethyl)-3,4-dimethyl-1H-pyrrole-2-carboxylate
Wiley ID 1483212