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(2E,4E)-1-(Pyrrolidin-1-yl)octadeca-2,4-dien-1-one

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

(2E,4E)-1-(Pyrrolidin-1-yl)octadeca-2,4-dien-1-one
SpectraBase Compound ID 7SAV2EtSHpq
InChI InChI=1S/C22H39NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22(24)23-20-17-18-21-23/h14-16,19H,2-13,17-18,20-21H2,1H3/b15-14+,19-16+
InChIKey AVSSMWIINDFJMN-VNXILKCPSA-N
Mol Weight 333.6 g/mol
Molecular Formula C22H39NO
Exact Mass 333.303165 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8NJu1gqJusn
Name (2E,4E)-1-(Pyrrolidin-1-yl)octadeca-2,4-dien-1-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 333.303164879 u
Formula C22H39NO
InChI InChI=1S/C22H39NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22(24)23-20-17-18-21-23/h14-16,19H,2-13,17-18,20-21H2,1H3/b15-14+,19-16+
InChIKey AVSSMWIINDFJMN-VNXILKCPSA-N
Molecular Weight 333.560 g/mol
SMILES C1N(CCC1)C(\C=C\C=C\CCCCCCCCCCCCC)=O