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Picolinyl 10,13-octadecadienoate

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

Picolinyl 10,13-octadecadienoate
SpectraBase Compound ID L21Nyjn8WaP
InChI InChI=1S/C24H37NO2/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/h5-6,8-9,17-18,20-21H,2-4,7,10-16,19,22H2,1H3/b6-5-,9-8-
InChIKey CHXFCARURFVEBU-AFJQJTPPSA-N
Mol Weight 371.6 g/mol
Molecular Formula C24H37NO2
Exact Mass 371.282429 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9gvAkKMwSwU
Name Picolinyl 10,13-octadecadienoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 371.282429433 u
Formula C24H37NO2
InChI InChI=1S/C24H37NO2/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/h5-6,8-9,17-18,20-21H,2-4,7,10-16,19,22H2,1H3/b6-5-,9-8-
InChIKey CHXFCARURFVEBU-AFJQJTPPSA-N
Molecular Weight 371.565 g/mol
SMILES C1=CN=CC(=C1)COC(CCCCCCCC\C=C/C\C=C/CCCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.933281