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

*Links on SpectraBase are not permalinks.
Pyridinyl-3-methyl 13,14-epoxydocosa-4,7,10,16,19-pentaenoate
SpectraBase Compound ID 6WroreBRSB0
InChI InChI=1S/C28H37NO3/c1-3-4-5-6-11-14-19-25-26(31-25)20-15-12-9-7-8-10-13-18-24(2)23-28(30)32-27-21-16-17-22-29-27/h4-5,7-8,11-18,21-22,24-26H,3,6,9-10,19-20,23H2,1-2H3/b5-4+,8-7+,14-11+,15-12+,18-13+
InChIKey PFYQTPAJAWNOAY-CGAWKMNZSA-N
Mol Weight 435.6 g/mol
Molecular Formula C28H37NO3
Exact Mass 435.277344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 4z9DuIQ7RmP
Name Pyridinyl-3-methyl 13,14-epoxydocosa-4,7,10,16,19-pentaenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H37NO3
InChI InChI=1S/C28H37NO3/c1-3-4-5-6-11-14-19-25-26(31-25)20-15-12-9-7-8-10-13-18-24(2)23-28(30)32-27-21-16-17-22-29-27/h4-5,7-8,11-18,21-22,24-26H,3,6,9-10,19-20,23H2,1-2H3/b5-4+,8-7+,14-11+,15-12+,18-13+
InChIKey PFYQTPAJAWNOAY-CGAWKMNZSA-N
Molecular Weight 435.608 g/mol
SMILES C1(OC1C\C=C\C\C=C\C\C=C\C(CC(Oc1ncccc1)=O)C)C\C=C\C\C=C\CC
SPLASH splash10-0fsl-9430000000-81dd71d91c15cb483b44
Source of Spectrum KO-18-333-3
Synonyms 2-Pyridinyl (4E,7E,10E)-3-methyl-12-{3-[(2E,5E)-2,5-octadienyl]-2-oxiranyl}-4,7,10-dodecatrienoate
Wiley ID 1383300