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2,14-Dimethyl-6,10-dimethylene-9-(3-methylpent-4-en-1-yl)pentadecan-7-one
SpectraBase Compound ID J0wsCAYOYo
InChI InChI=1S/C25H44O/c1-9-21(6)16-17-24(22(7)14-10-12-19(2)3)18-25(26)23(8)15-11-13-20(4)5/h9,19-21,24H,1,7-8,10-18H2,2-6H3
InChIKey XTJROYQXOHLUCZ-UHFFFAOYSA-N
Mol Weight 360.6 g/mol
Molecular Formula C25H44O
Exact Mass 360.339216 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JbkMDB6J8jY
Name 2,14-Dimethyl-6,10-dimethylene-9-(3-methylpent-4-en-1-yl)pentadecan-7-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 360.339216036 u
Formula C25H44O
InChI InChI=1S/C25H44O/c1-9-21(6)16-17-24(22(7)14-10-12-19(2)3)18-25(26)23(8)15-11-13-20(4)5/h9,19-21,24H,1,7-8,10-18H2,2-6H3
InChIKey XTJROYQXOHLUCZ-UHFFFAOYSA-N
Molecular Weight 360.626 g/mol
SMILES CC(CCCC(C(CC(C(CCCC(C)C)=C)=O)CCC(C=C)C)=C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.927249