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5-(3-Cyclohexylprop-1-ynyl)nicotinic acid

View entire compound with spectra: 1 MS (GC)

5-(3-Cyclohexylprop-1-ynyl)nicotinic acid
SpectraBase Compound ID 7E7ylhxlBE2
InChI InChI=1S/C15H17NO2/c17-15(18)14-9-13(10-16-11-14)8-4-7-12-5-2-1-3-6-12/h9-12H,1-3,5-7H2,(H,17,18)
InChIKey OIXZVVLCCMRMDO-UHFFFAOYSA-N
Mol Weight 243.31 g/mol
Molecular Formula C15H17NO2
Exact Mass 243.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Xp8HHaHWKr
Name 5-(3-Cyclohexylprop-1-ynyl)nicotinic acid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17NO2
InChI InChI=1S/C15H17NO2/c17-15(18)14-9-13(10-16-11-14)8-4-7-12-5-2-1-3-6-12/h9-12H,1-3,5-7H2,(H,17,18)
InChIKey OIXZVVLCCMRMDO-UHFFFAOYSA-N
Molecular Weight 243.306 g/mol
SMILES OC(c1cc(C#CCC2CCCCC2)cnc1)=O
SPLASH splash10-0bt9-9410000000-2b6ad8cc0573d7004131
Source of Spectrum AD-0-2532-0
Synonyms 5-(3-Cyclohexyl-1-propynyl)nicotinic acid 5-(3-cyclohexylprop-1-ynyl)-3-pyridinecarboxylic acid 5-(3-cyclohexylprop-1-ynyl)pyridine-3-carboxylic acid
Wiley ID 1428165