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3-Hexyl-2,5-dipentylpentanedial
SpectraBase Compound ID Fv5viJ9tTVi
InChI InChI=1S/C21H40O2/c1-4-7-10-13-14-19(17-21(23)16-12-9-6-3)20(18-22)15-11-8-5-2/h18-20H,4-17H2,1-3H3
InChIKey FGGZBTMVRBWDIN-UHFFFAOYSA-N
Mol Weight 324.5 g/mol
Molecular Formula C21H40O2
Exact Mass 324.302831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IQLg3sfYEZX
Name 3-Hexyl-2,5-dipentylpentanedial
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H40O2
InChI InChI=1S/C21H40O2/c1-4-7-10-13-14-19(17-21(23)16-12-9-6-3)20(18-22)15-11-8-5-2/h18-20H,4-17H2,1-3H3
InChIKey FGGZBTMVRBWDIN-UHFFFAOYSA-N
Literature Reference DOI 10.1002_1615-4169(200212)344_10_1090
Molecular Weight 324.549 g/mol
SMILES C(C(C(CC(=O)CCCCC)CCCCCC)CCCCC)=O
SPLASH splash10-0udi-1090000000-2319b05318066827d6e4
Source of Spectrum ASC-344-1096-5
Synonyms 3-Hexyl-5-oxo-2-pentyldecanal
Wiley ID 1767173