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2,2-Dimethyl-4-(2-oxo-1H-6-pyridyl)-3-butynoic acid
SpectraBase Compound ID 1Yc5r2XQTCS
InChI InChI=1S/C11H11NO3/c1-11(2,10(14)15)7-6-8-4-3-5-9(13)12-8/h3-5H,1-2H3,(H,12,13)(H,14,15)
InChIKey BJYDMMBJRFTNNQ-UHFFFAOYSA-N
Mol Weight 205.21 g/mol
Molecular Formula C11H11NO3
Exact Mass 205.073893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LwIQkQNmbLC
Name 2,2-Dimethyl-4-(2-oxo-1H-6-pyridyl)-3-butynoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11NO3
InChI InChI=1S/C11H11NO3/c1-11(2,10(14)15)7-6-8-4-3-5-9(13)12-8/h3-5H,1-2H3,(H,12,13)(H,14,15)
InChIKey BJYDMMBJRFTNNQ-UHFFFAOYSA-N
Molecular Weight 205.213 g/mol
SMILES N1C(C=CC=C1C#CC(C(=O)O)(C)C)=O
SPLASH splash10-08fr-0960000000-bdf76e18b221aec2b0e7
Source of Spectrum C-119-3806-1
Synonyms 2,2-Dimethyl-4-(6-oxo-1,6-dihydro-2-pyridinyl)-3-butynoic acid 2,2-Dimethyl-4-(6-oxo-1,6-dihydro-pyridin-2-yl)-but-3-ynoic acid
Wiley ID 760376