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4-Methyl-6-(2,2,3-trimethylcyclopentyl)hexanal

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

4-Methyl-6-(2,2,3-trimethylcyclopentyl)hexanal
SpectraBase Compound ID 8Sy17gGpIMC
InChI InChI=1S/C15H28O/c1-12(6-5-11-16)7-9-14-10-8-13(2)15(14,3)4/h11-14H,5-10H2,1-4H3
InChIKey SATSLDXTNFESAE-UHFFFAOYSA-N
Mol Weight 224.39 g/mol
Molecular Formula C15H28O
Exact Mass 224.214016 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID ApXIn67SvR8
Name 4-Methyl-6-(2,2,3-trimethylcyclopentyl)hexanal
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 224.214015521 u
Formula C15H28O
InChI InChI=1S/C15H28O/c1-12(6-5-11-16)7-9-14-10-8-13(2)15(14,3)4/h11-14H,5-10H2,1-4H3
InChIKey SATSLDXTNFESAE-UHFFFAOYSA-N
Molecular Weight 224.388 g/mol
SMILES C1(CCC(CCC=O)C)CCC(C1(C)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.948501