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Picolinyl 12-octadecenoate

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

Picolinyl 12-octadecenoate
SpectraBase Compound ID Dy2ebyOSP7n
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/h6-7,17-18,20-21H,2-5,8-16,19,22H2,1H3/b7-6-
InChIKey KJEFUIYZOOFVAJ-SREVYHEPSA-N
Mol Weight 373.6 g/mol
Molecular Formula C24H39NO2
Exact Mass 373.298079 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CuxekmcmmDH
Name Picolinyl 12-octadecenoate
Comments Computed using SmartSpectra Model v1.42
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/h6-7,17-18,20-21H,2-5,8-16,19,22H2,1H3/b7-6-
InChIKey KJEFUIYZOOFVAJ-SREVYHEPSA-N
Molecular Weight 373.581 g/mol
SMILES C1=CN=CC(=C1)COC(CCCCCCCCCC\C=C/CCCCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.964676