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Pyridine-3-carboxylic acid, 5-(3-hydroxy-3-methyl-1-butynyl)-, ethyl ester
SpectraBase Compound ID 54Ir3AM9ERf
InChI InChI=1S/C13H15NO3/c1-4-17-12(15)11-7-10(8-14-9-11)5-6-13(2,3)16/h7-9,16H,4H2,1-3H3
InChIKey FRMOJEIUPLKZRS-UHFFFAOYSA-N
Mol Weight 233.27 g/mol
Molecular Formula C13H15NO3
Exact Mass 233.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GXkvoieWEk2
Name Pyridine-3-carboxylic acid, 5-(3-hydroxy-3-methyl-1-butynyl)-, ethyl ester
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Formula C13H15NO3
InChI InChI=1S/C13H15NO3/c1-4-17-12(15)11-7-10(8-14-9-11)5-6-13(2,3)16/h7-9,16H,4H2,1-3H3
InChIKey FRMOJEIUPLKZRS-UHFFFAOYSA-N
Molecular Weight 233.267 g/mol
SMILES OC(C#Cc1cc(C(=O)OCC)cnc1)(C)C
SPLASH splash10-014l-6890000000-fa17599d8b672cafb6b7
Source of Spectrum AD-0-2532-0
Synonyms 5-(3-hydroxy-3-methyl-but-1-ynyl)nicotinic acid ethyl ester 5-(3-hydroxy-3-methylbut-1-ynyl)-3-pyridinecarboxylic acid ethyl ester Ethyl 5-(3-hydroxy-3-methyl-1-butynyl)nicotinate Ethyl 5-(3-hydroxy-3-methyl-but-1-ynyl)pyridine-3-carboxylate Ethyl 5-(3-methyl-3-oxidanyl-but-1-ynyl)pyridine-3-carboxylate
Wiley ID 1427802