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2-(1-Butyl-1H-pyrrol-2-yl)hexanoic acid methyl ester
SpectraBase Compound ID 6uMsl2RmFOF
InChI InChI=1S/C15H25NO2/c1-4-6-9-13(15(17)18-3)14-10-8-12-16(14)11-7-5-2/h8,10,12-13H,4-7,9,11H2,1-3H3
InChIKey BNOMQNKVIFUQSS-UHFFFAOYSA-N
Mol Weight 251.37 g/mol
Molecular Formula C15H25NO2
Exact Mass 251.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4pflfrrtLjJ
Name 2-(1-Butyl-1H-pyrrol-2-yl)hexanoic acid methyl ester
Alternate Name(s) Methyl 2-(1-butyl-1H-pyrrol-2-yl)hexanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H25NO2
InChI InChI=1S/C15H25NO2/c1-4-6-9-13(15(17)18-3)14-10-8-12-16(14)11-7-5-2/h8,10,12-13H,4-7,9,11H2,1-3H3
InChIKey BNOMQNKVIFUQSS-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200606085
Molecular Weight 251.370 g/mol
SMILES C(C(CCCC)c1[n](ccc1)CCCC)(=O)OC
SPLASH splash10-0006-1910000000-5521fc4d1e62d7f0f96b
Source of Spectrum ASC-348-2212/SM5-2d
Wiley ID 1764991