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5-(1-Pyrrolyl)pentanoic Acid

View entire compound with spectra: 1 MS (GC)

5-(1-Pyrrolyl)pentanoic Acid
SpectraBase Compound ID C9xyYLqGL4f
InChI InChI=1S/C9H13NO2/c11-9(12)5-1-2-6-10-7-3-4-8-10/h3-4,7-8H,1-2,5-6H2,(H,11,12)
InChIKey AVEVRCSCWPFBMP-UHFFFAOYSA-N
Mol Weight 167.21 g/mol
Molecular Formula C9H13NO2
Exact Mass 167.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8HQaq1wzSXl
Name 5-(1-Pyrrolyl)pentanoic Acid
Alternate Name(s) 5-(1H-pyrrol-1-yl)pentanoic acid 5-Pyrrol-1-ylpentanoic acid 5-Pyrrol-1-ylvaleric acid
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Formula C9H13NO2
InChI InChI=1S/C9H13NO2/c11-9(12)5-1-2-6-10-7-3-4-8-10/h3-4,7-8H,1-2,5-6H2,(H,11,12)
InChIKey AVEVRCSCWPFBMP-UHFFFAOYSA-N
Molecular Weight 167.208 g/mol
SMILES OC(CCCC[n]1cccc1)=O
SPLASH splash10-00lr-9400000000-4acd339feebe9b05b353
Source of Spectrum J-58-518-3
Wiley ID 1163665