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2-(3,5-dimethyl-1H-pyrrol-2-yl)butanoic acid

View entire compound with spectra: 1 MS (GC)

2-(3,5-dimethyl-1H-pyrrol-2-yl)butanoic acid
SpectraBase Compound ID 9tFKQX6wSB7
InChI InChI=1S/C10H15NO2/c1-4-8(10(12)13)9-6(2)5-7(3)11-9/h5,8,11H,4H2,1-3H3,(H,12,13)
InChIKey GACMEGLVUBPIAV-UHFFFAOYSA-N
Mol Weight 181.23 g/mol
Molecular Formula C10H15NO2
Exact Mass 181.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4tjsl2KaBdr
Name 2-(3,5-dimethyl-1H-pyrrol-2-yl)butanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H15NO2
InChI InChI=1S/C10H15NO2/c1-4-8(10(12)13)9-6(2)5-7(3)11-9/h5,8,11H,4H2,1-3H3,(H,12,13)
InChIKey GACMEGLVUBPIAV-UHFFFAOYSA-N
Literature Reference DOI 10.1039/C6RA05348C
Molecular Weight 181.235 g/mol
SMILES [nH]1c(C(C(O)=O)CC)c(cc1C)C
SPLASH splash10-001r-1900000000-9e6d53df9cf05df47cae
Source of Spectrum RSA-6-44341/SM4-5kc
Wiley ID 1807195