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Picolinyl 12-nonadecenoate

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

Picolinyl 12-nonadecenoate
SpectraBase Compound ID EuDyvajRggn
InChI InChI=1S/C25H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-25(27)28-23-24-19-18-21-26-22-24/h7-8,18-19,21-22H,2-6,9-17,20,23H2,1H3/b8-7-
InChIKey QMTZILZHALHFEW-FPLPWBNLSA-N
Mol Weight 387.6 g/mol
Molecular Formula C25H41NO2
Exact Mass 387.31373 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Au9haxAVO45
Name Picolinyl 12-nonadecenoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 387.313729562 u
Formula C25H41NO2
InChI InChI=1S/C25H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-25(27)28-23-24-19-18-21-26-22-24/h7-8,18-19,21-22H,2-6,9-17,20,23H2,1H3/b8-7-
InChIKey QMTZILZHALHFEW-FPLPWBNLSA-N
Molecular Weight 387.608 g/mol
SMILES C1=CN=CC(=C1)COC(CCCCCCCCCC\C=C/CCCCCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.966468