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Nicotinic acid, cyclobutyl ester

View entire compound with spectra: 1 MS (GC)

Nicotinic acid, cyclobutyl ester
SpectraBase Compound ID 4CiKXMo6XDi
InChI InChI=1S/C10H11NO2/c12-10(13-9-4-1-5-9)8-3-2-6-11-7-8/h2-3,6-7,9H,1,4-5H2
InChIKey KFXYNZKFNAKUJG-UHFFFAOYSA-N
Mol Weight 177.2 g/mol
Molecular Formula C10H11NO2
Exact Mass 177.078979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GhC3tl1IdKQ
Name Nicotinic acid, cyclobutyl ester
Alternate Name(s) 3-Pyridinecarboxylic acid cyclobutyl ester cyclobutyl pyridine-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11NO2
InChI InChI=1S/C10H11NO2/c12-10(13-9-4-1-5-9)8-3-2-6-11-7-8/h2-3,6-7,9H,1,4-5H2
InChIKey KFXYNZKFNAKUJG-UHFFFAOYSA-N
Molecular Weight 177.203 g/mol
SMILES c1ncc(cc1)C(OC1CCC1)=O
SPLASH splash10-0a4i-3900000000-3e434a34aac3a11e2bde
Source of Spectrum NP-2-8140-0
Wiley ID 1101727