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8-Hydroxy-2,2,8-trimethyl-deca-5,9-dien-3-one

View entire compound with spectra: 1 FTIR, and 3 MS (GC)

8-Hydroxy-2,2,8-trimethyl-deca-5,9-dien-3-one
SpectraBase Compound ID 5MJdnsMpEPm
InChI InChI=1S/C13H22O2/c1-6-13(5,15)10-8-7-9-11(14)12(2,3)4/h6-8,15H,1,9-10H2,2-5H3/b8-7+
InChIKey YPYZNPYPMMYZSR-BQYQJAHWSA-N
Mol Weight 210.32 g/mol
Molecular Formula C13H22O2
Exact Mass 210.16198 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6aeWetlP9xq
Name 8-Hydroxy-2,2,8-trimethyldeca-5,9-dien-3-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 210.161979946 u
Formula C13H22O2
InChI InChI=1S/C13H22O2/c1-6-13(5,15)10-8-7-9-11(14)12(2,3)4/h6-8,15H,1,9-10H2,2-5H3/b8-7+
InChIKey YPYZNPYPMMYZSR-BQYQJAHWSA-N
Molecular Weight 210.317 g/mol
SMILES C(=O)(C(C)(C)C)C\C=C\CC(C)(C=C)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.849548