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2,3-Dihydrofarnesyl hexanoate

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2,3-Dihydrofarnesyl hexanoate
SpectraBase Compound ID 6tShkI3crEy
InChI InChI=1S/C21H38O2/c1-6-7-8-15-21(22)23-17-16-20(5)14-10-13-19(4)12-9-11-18(2)3/h11,13,20H,6-10,12,14-17H2,1-5H3/b19-13+
InChIKey OVGPJUKPIAHWGH-CPNJWEJPSA-N
Mol Weight 322.5 g/mol
Molecular Formula C21H38O2
Exact Mass 322.28718 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3UlyaVdDSs1
Name 2,3-Dihydrofarnesyl hexanoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 322.287180462 u
Formula C21H38O2
InChI InChI=1S/C21H38O2/c1-6-7-8-15-21(22)23-17-16-20(5)14-10-13-19(4)12-9-11-18(2)3/h11,13,20H,6-10,12,14-17H2,1-5H3/b19-13+
InChIKey OVGPJUKPIAHWGH-CPNJWEJPSA-N
Molecular Weight 322.533 g/mol
SMILES CC(C)=CCC\C(=C\CCC(CCOC(CCCCC)=O)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.96418