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4-FORMYL-5-METHYLPYRROL-2-CARBONSAEUREETHYLESTER

View entire compound with spectra: 3 NMR, and 2 MS (GC)

4-FORMYL-5-METHYLPYRROL-2-CARBONSAEUREETHYLESTER
SpectraBase Compound ID A5NEIrIhmXg
InChI InChI=1S/C9H11NO3/c1-3-13-9(12)8-4-7(5-11)6(2)10-8/h4-5,10H,3H2,1-2H3
InChIKey IREKIHPINCBPHF-UHFFFAOYSA-N
Mol Weight 181.19 g/mol
Molecular Formula C9H11NO3
Exact Mass 181.073893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 70l4yi9hubu
Name 4-formyl-5-methyl-1H-pyrrole-2-carboxylic acid ethyl ester
Alternate Name(s) Ethyl 4-formyl-5-methyl-1H-pyrrole-2-carboxylate Ethyl 4-methanoyl-5-methyl-1H-pyrrole-2-carboxylate
CAS Registry Number 25907-30-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11NO3
InChI InChI=1S/C9H11NO3/c1-3-13-9(12)8-4-7(5-11)6(2)10-8/h4-5,10H,3H2,1-2H3
InChIKey IREKIHPINCBPHF-UHFFFAOYSA-N
Molecular Weight 181.191 g/mol
SMILES [nH]1c(c(cc1C(=O)OCC)C=O)C
SPLASH splash10-0uei-8900000000-30e9237da941c0c20ce0
Source of Spectrum AD-0-2532-0
Wiley ID 1435685