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Octacosa-10,12,14,16,18-pentaene-dioic acid
SpectraBase Compound ID 7Nj83p5ghrg
InChI InChI=1S/C28H44O4/c29-27(30)25-23-21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-22-24-26-28(31)32/h1-10H,11-26H2,(H,29,30)(H,31,32)/b2-1+,5-3+,6-4+,9-7+,10-8+
InChIKey BTWMLXGZJLGGRP-CLQTYQDTSA-N
Mol Weight 444.7 g/mol
Molecular Formula C28H44O4
Exact Mass 444.32396 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7rWegTFlT4h
Name Octacosa-10,12,14,16,18-pentaene-dioic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H44O4
InChI InChI=1S/C28H44O4/c29-27(30)25-23-21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-22-24-26-28(31)32/h1-10H,11-26H2,(H,29,30)(H,31,32)/b2-1+,5-3+,6-4+,9-7+,10-8+
InChIKey BTWMLXGZJLGGRP-CLQTYQDTSA-N
Molecular Weight 444.656 g/mol
SMILES OC(CCCCCCCC\C=C\C=C\C=C\C=C\C=C\CCCCCCCCC(=O)O)=O
SPLASH splash10-0006-4900300000-79c7e11afb4ece66d0cc
Source of Spectrum U1-2003-1315-5
Synonyms (10E,12E,14E,16E,18E)-10,12,14,16,18-octacosapentaenedioic acid
Wiley ID 1523686