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2,6,10,14-Heptadecanetetrone
SpectraBase Compound ID 1efzaKHa6Ly
InChI InChI=1S/C17H28O4/c1-3-7-15(19)10-5-11-17(21)13-6-12-16(20)9-4-8-14(2)18/h3-13H2,1-2H3
InChIKey KLSPWSUPQKVPLO-UHFFFAOYSA-N
Mol Weight 296.41 g/mol
Molecular Formula C17H28O4
Exact Mass 296.198759 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2aJLwusnpRr
Name 2,6,10,14-Heptadecanetetrone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 296.198759378 u
Formula C17H28O4
InChI InChI=1S/C17H28O4/c1-3-7-15(19)10-5-11-17(21)13-6-12-16(20)9-4-8-14(2)18/h3-13H2,1-2H3
InChIKey KLSPWSUPQKVPLO-UHFFFAOYSA-N
Molecular Weight 296.407 g/mol
SMILES CC(CCCC(CCCC(CCCC(CCC)=O)=O)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.953457