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Ethyl-(E,E,E)-[1-(14)C]-dehydrofarnesate
SpectraBase Compound ID D3VYbtONjrD
InChI InChI=1S/C17H26O2/c1-6-19-17(18)13-16(5)12-8-11-15(4)10-7-9-14(2)3/h8-9,11-13H,6-7,10H2,1-5H3/b12-8+,15-11+,16-13+
InChIKey IXLSHKVMEQBNOO-LLKPRGDRSA-N
Mol Weight 262.39 g/mol
Molecular Formula C17H26O2
Exact Mass 262.19328 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LYjNZ2IswUa
Name Ethyl-(E,E,E)-[1-(14)C]-dehydrofarnesate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 262.193280075 u
Formula C17H26O2
InChI InChI=1S/C17H26O2/c1-6-19-17(18)13-16(5)12-8-11-15(4)10-7-9-14(2)3/h8-9,11-13H,6-7,10H2,1-5H3/b12-8+,15-11+,16-13+
InChIKey IXLSHKVMEQBNOO-LLKPRGDRSA-N
Molecular Weight 262.393 g/mol
SMILES C(=O)(\C=C\(\C=C\C=C\(CCC=C(C)C)C)C)OCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.903406