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Heneicosa-2,9,16-triene-1,8,15-triolide
SpectraBase Compound ID KaThqLintmX
InChI InChI=1S/C21H30O6/c22-19-13-7-3-1-2-4-10-16-25-20(23)14-8-5-12-18-27-21(24)15-9-6-11-17-26-19/h7-9,13-15H,1-6,10-12,16-18H2/b13-7+,14-8+,15-9+
InChIKey NBWMRQIUMQXNTK-ZOWBABNGSA-N
Mol Weight 378.47 g/mol
Molecular Formula C21H30O6
Exact Mass 378.204239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DXImLBCn8UM
Name Heneicosa-2,9,16-triene-1,8,15-triolide
Alternate Name(s) 1,8,15-trioxacyclotetracosa-3,10,17-triene-2,9,16-trione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O6
InChI InChI=1S/C21H30O6/c22-19-13-7-3-1-2-4-10-16-25-20(23)14-8-5-12-18-27-21(24)15-9-6-11-17-26-19/h7-9,13-15H,1-6,10-12,16-18H2/b13-7+,14-8+,15-9+
InChIKey NBWMRQIUMQXNTK-ZOWBABNGSA-N
Molecular Weight 378.465 g/mol
SMILES C1(OCCCCCC\C=C\C(OCCC\C=C\C(OCCC\C=C\1)=O)=O)=O
SPLASH splash10-0a59-5900000000-6fe40492e97632638e9e
Source of Spectrum AC-1991-752-8
Wiley ID 747887