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3-(Pyrrol-1-yl)hexanoic acid
SpectraBase Compound ID ItglPo9Hu8f
InChI InChI=1S/C10H15NO2/c1-2-5-9(8-10(12)13)11-6-3-4-7-11/h3-4,6-7,9H,2,5,8H2,1H3,(H,12,13)/t9-/m0/s1
InChIKey MTFSTGHGYXOSTH-VIFPVBQESA-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 5qC1WPaM1AM
Name 3-(Pyrrol-1-yl)hexanoic acid
Alternate Name(s) (S)-3-(Pyrrol-1-yl)hexanoic acid 3-(1H-pyrrol-1-yl)hexanoic acid
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Formula C10H15NO2
InChI InChI=1S/C10H15NO2/c1-2-5-9(8-10(12)13)11-6-3-4-7-11/h3-4,6-7,9H,2,5,8H2,1H3,(H,12,13)/t9-/m0/s1
InChIKey MTFSTGHGYXOSTH-VIFPVBQESA-N
Molecular Weight 181.235 g/mol
SMILES OC(C[C@@]([n]1cccc1)(CCC)[H])=O
SPLASH splash10-00l6-9600000000-76e53277afb20f87b0e0
Source of Spectrum AT-34-3122-14
Wiley ID 852413