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1(2H)-Pyridinecarboxylic acid, 2-(1-hexynyl)-, methyl ester
SpectraBase Compound ID G06VHdArZO5
InChI InChI=1S/C13H17NO2/c1-3-4-5-6-9-12-10-7-8-11-14(12)13(15)16-2/h7-8,10-12H,3-5H2,1-2H3
InChIKey XAQHIUVXVVWNBC-UHFFFAOYSA-N
Mol Weight 219.28 g/mol
Molecular Formula C13H17NO2
Exact Mass 219.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7T5KwIGHQyO
Name 1(2H)-Pyridinecarboxylic acid, 2-(1-hexynyl)-, methyl ester
CAS Registry Number 86951-01-1
Comments Less than 3 mono-isotopic peaks
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Formula C13H17NO2
InChI InChI=1S/C13H17NO2/c1-3-4-5-6-9-12-10-7-8-11-14(12)13(15)16-2/h7-8,10-12H,3-5H2,1-2H3
InChIKey XAQHIUVXVVWNBC-UHFFFAOYSA-N
Molecular Weight 219.284 g/mol
SMILES C(N1C(C#CCCCC)C=CC=C1)(=O)OC
SPLASH splash10-016r-5090000000-4c1427542f42041a64cf
Source of Spectrum AJ-60-219-2
Synonyms 1-Methoxycarbonyl-2-(1-hexynyl)-1,2-dihydropyridine methyl 2-(1-hexynyl)-1(2H)-pyridinecarboxylate
Wiley ID 1218933