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(8Z)-6,6-dimethylundeca-3,4,8-triene-2,10-dione

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

(8Z)-6,6-dimethylundeca-3,4,8-triene-2,10-dione
SpectraBase Compound ID 6NBhWHbRsUc
InChI InChI=1S/C13H18O2/c1-11(14)7-5-9-13(3,4)10-6-8-12(2)15/h5,7-8,10H,9H2,1-4H3/b7-5-
InChIKey HOBQMLLKPOKFCR-ALCCZGGFSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Ev4qBF2vp8f
Name (8Z)-6,6-Dimethylundeca-3,4,8-triene-2,10-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 206.130679818 u
Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-11(14)7-5-9-13(3,4)10-6-8-12(2)15/h5,7-8,10H,9H2,1-4H3/b7-5-
InChIKey HOBQMLLKPOKFCR-ALCCZGGFSA-N
Molecular Weight 206.285 g/mol
SMILES C(=C=CC(=O)C)C(C\C=C/C(=O)C)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.943051