For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Picolinyl 12,13-tetradecadienoate

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

Picolinyl 12,13-tetradecadienoate
SpectraBase Compound ID KKSoyKzpQ1i
InChI InChI=1S/C20H29NO2/c1-2-3-4-5-6-7-8-9-10-11-12-15-20(22)23-18-19-14-13-16-21-17-19/h3,13-14,16-17H,1,4-12,15,18H2
InChIKey QHMLSHSDFHJNDJ-UHFFFAOYSA-N
Mol Weight 315.46 g/mol
Molecular Formula C20H29NO2
Exact Mass 315.219829 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID EEGmM3U5LrE
Name Picolinyl 12,13-tetradecadienoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 315.219829176 u
Formula C20H29NO2
InChI InChI=1S/C20H29NO2/c1-2-3-4-5-6-7-8-9-10-11-12-15-20(22)23-18-19-14-13-16-21-17-19/h3,13-14,16-17H,1,4-12,15,18H2
InChIKey QHMLSHSDFHJNDJ-UHFFFAOYSA-N
Molecular Weight 315.457 g/mol
SMILES C(CC(=O)OCC1=CC=CN=C1)CCCCCCCCC=C=C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.823877