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4,6-Diisohexyl-6-methylcyclohex-3-ene-carbaldehyde

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

4,6-Diisohexyl-6-methylcyclohex-3-ene-carbaldehyde
SpectraBase Compound ID JxpaExcZjTE
InChI InChI=1S/C20H36O/c1-16(2)8-6-10-18-11-12-19(15-21)20(5,14-18)13-7-9-17(3)4/h11,15-17,19H,6-10,12-14H2,1-5H3
InChIKey OQVSZMZREUHXDO-UHFFFAOYSA-N
Mol Weight 292.5 g/mol
Molecular Formula C20H36O
Exact Mass 292.276616 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KZW8wvUzYDK
Name 4,6-Diisohexyl-6-methylcyclohex-3-ene-carbaldehyde
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 292.276615778 u
Formula C20H36O
InChI InChI=1S/C20H36O/c1-16(2)8-6-10-18-11-12-19(15-21)20(5,14-18)13-7-9-17(3)4/h11,15-17,19H,6-10,12-14H2,1-5H3
InChIKey OQVSZMZREUHXDO-UHFFFAOYSA-N
SMILES C1(CC=C(CC1(C)CCCC(C)C)CCCC(C)C)C=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.962348