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2-(1-Butyl-4-ethyl-1H-pyrrol-2-yl)acetic acid methyl ester
SpectraBase Compound ID Ap79BNpBRSX
InChI InChI=1S/C13H21NO2/c1-4-6-7-14-10-11(5-2)8-12(14)9-13(15)16-3/h8,10H,4-7,9H2,1-3H3
InChIKey WITGVKNKPAVFTR-UHFFFAOYSA-N
Mol Weight 223.32 g/mol
Molecular Formula C13H21NO2
Exact Mass 223.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AJEf4x8ONf5
Name 2-(1-Butyl-4-ethyl-1H-pyrrol-2-yl)acetic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H21NO2
InChI InChI=1S/C13H21NO2/c1-4-6-7-14-10-11(5-2)8-12(14)9-13(15)16-3/h8,10H,4-7,9H2,1-3H3
InChIKey WITGVKNKPAVFTR-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200606085
Molecular Weight 223.316 g/mol
SMILES C(Cc1[n](cc(c1)CC)CCCC)(=O)OC
SPLASH splash10-03k9-0910000000-72119cd9ac05f59cb1a2
Source of Spectrum ASC-348-2212/SM5-2b
Synonyms Methyl 2-(1-butyl-4-ethyl-1H-pyrrol-2-yl)acetate 2-(1-butyl-4-ethyl-2-pyrrolyl)acetic acid methyl ester Methyl 2-(1-butyl-4-ethylpyrrol-2-yl)acetate Methyl 2-(1-butyl-4-ethyl-pyrrol-2-yl)acetate Methyl 2-(1-butyl-4-ethyl-pyrrol-2-yl)ethanoate
Wiley ID 1764989