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3-Pyridineacetic acid, 1,2,5,6-tetrahydro-1-methyl-2-oxo-4-phenyl-
SpectraBase Compound ID Fd8BMOkOgRb
InChI InChI=1S/C14H15NO3/c1-15-8-7-11(10-5-3-2-4-6-10)12(14(15)18)9-13(16)17/h2-6H,7-9H2,1H3,(H,16,17)
InChIKey MCBMFBOTSPBGRJ-UHFFFAOYSA-N
Mol Weight 245.28 g/mol
Molecular Formula C14H15NO3
Exact Mass 245.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CK7NL89vI7W
Name 3-Pyridineacetic acid, 1,2,5,6-tetrahydro-1-methyl-2-oxo-4-phenyl-
CAS Registry Number 61209-81-2
Comments Less than 3 mono-isotopic peaks
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Formula C14H15NO3
InChI InChI=1S/C14H15NO3/c1-15-8-7-11(10-5-3-2-4-6-10)12(14(15)18)9-13(16)17/h2-6H,7-9H2,1H3,(H,16,17)
InChIKey MCBMFBOTSPBGRJ-UHFFFAOYSA-N
Molecular Weight 245.278 g/mol
SMILES OC(CC=1C(N(C)CCC1c1ccccc1)=O)=O
SPLASH splash10-0udi-0090000000-8aa290f0194d83882a74
Source of Spectrum C-98-6655-0
Synonyms (1-methyl-2-oxo-4-phenyl-1,2,5,6-tetrahydro-3-pyridinyl)acetic acid 3-Carboxymethyl-1-methyl-4-phenyl-5,6-dihydro-2-pyridone
Wiley ID 1247998