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cis-13-Octadecenoic acid, picolinyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

cis-13-Octadecenoic acid, picolinyl ester
SpectraBase Compound ID BxqLZ0fpFjd
InChI InChI=1S/C24H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-24(26)27-22-23-18-17-20-25-21-23/h5-6,17-18,20-21H,2-4,7-16,19,22H2,1H3/b6-5-
InChIKey ZVJYPIYQJKXDJB-WAYWQWQTSA-N
Mol Weight 373.6 g/mol
Molecular Formula C24H39NO2
Exact Mass 373.298079 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IuASECUyQlx
Name cis-13-Octadecenoic acid, picolinyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 373.298079498 u
Formula C24H39NO2
InChI InChI=1S/C24H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-24(26)27-22-23-18-17-20-25-21-23/h5-6,17-18,20-21H,2-4,7-16,19,22H2,1H3/b6-5-
InChIKey ZVJYPIYQJKXDJB-WAYWQWQTSA-N
Molecular Weight 373.581 g/mol
SMILES C(=O)(OCC1=CN=CC=C1)CCCCCCCCCCC\C=C/CCCC