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Ethyl 3,7,11,15-tetramethyl-2-hexadecenoate

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Ethyl 3,7,11,15-tetramethyl-2-hexadecenoate
SpectraBase Compound ID 56yMHammy6E
InChI InChI=1S/C22H42O2/c1-7-24-22(23)17-21(6)16-10-15-20(5)14-9-13-19(4)12-8-11-18(2)3/h17-20H,7-16H2,1-6H3/b21-17+
InChIKey BOABYHFMEHVUTD-HEHNFIMWSA-N
Mol Weight 338.6 g/mol
Molecular Formula C22H42O2
Exact Mass 338.318481 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DBdOB0NjlG4
Name Ethyl 3,7,11,15-tetramethyl-2-hexadecenoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 338.318480590 u
Formula C22H42O2
InChI InChI=1S/C22H42O2/c1-7-24-22(23)17-21(6)16-10-15-20(5)14-9-13-19(4)12-8-11-18(2)3/h17-20H,7-16H2,1-6H3/b21-17+
InChIKey BOABYHFMEHVUTD-HEHNFIMWSA-N
Molecular Weight 338.576 g/mol
SMILES CCOC(\C=C\(CCCC(CCCC(CCCC(C)C)C)C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.946629