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3-Pyridinepentanoic acid, 1,2-dihydro-1-methyl-2-oxo-
SpectraBase Compound ID 99pTzLdZUhs
InChI InChI=1S/C11H15NO3/c1-12-8-4-6-9(11(12)15)5-2-3-7-10(13)14/h4,6,8H,2-3,5,7H2,1H3,(H,13,14)
InChIKey WBCJGYZAABXBON-UHFFFAOYSA-N
Mol Weight 209.24 g/mol
Molecular Formula C11H15NO3
Exact Mass 209.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GUnBBZw4JnL
Name 3-Pyridinepentanoic acid, 1,2-dihydro-1-methyl-2-oxo-
CAS Registry Number 100095-27-0
Comments Less than 3 mono-isotopic peaks
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Formula C11H15NO3
InChI InChI=1S/C11H15NO3/c1-12-8-4-6-9(11(12)15)5-2-3-7-10(13)14/h4,6,8H,2-3,5,7H2,1H3,(H,13,14)
InChIKey WBCJGYZAABXBON-UHFFFAOYSA-N
Molecular Weight 209.245 g/mol
SMILES OC(CCCCC=1C(N(C=CC1)C)=O)=O
SPLASH splash10-00di-0920000000-8b14e586349d067a76aa
Source of Spectrum K-118-3435-1
Synonyms 1,2-Dihydro-1-methyl-2-oxo-3-pyridinpentanoic acid 5-(1-methyl-2-oxo-1,2-dihydro-3-pyridinyl)pentanoic acid 5-(1-methyl-2-oxo-3-pyridinyl)pentanoic acid 5-(1-methyl-2-oxopyridin-3-yl)pentanoic acid 5-(1-methyl-2-oxo-3-pyridyl)pentanoic acid 5-(1-methyl-2-oxidanylidene-pyridin-3-yl)pentanoic acid
Wiley ID 1208120