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4-Isopropyl-3-(2-methyl-2-buten-4-yl)cyclohexanone

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

4-Isopropyl-3-(2-methyl-2-buten-4-yl)cyclohexanone
SpectraBase Compound ID 9wz9tkdrulY
InChI InChI=1S/C14H24O/c1-10(2)5-6-12-9-13(15)7-8-14(12)11(3)4/h5,11-12,14H,6-9H2,1-4H3
InChIKey DDPLLEGPDJBLHM-UHFFFAOYSA-N
Mol Weight 208.34 g/mol
Molecular Formula C14H24O
Exact Mass 208.182715 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID IWO9MIxrjWP
Name 4-Isopropyl-3-(2-methyl-2-buten-4-yl)cyclohexanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 208.182715392 u
Formula C14H24O
InChI InChI=1S/C14H24O/c1-10(2)5-6-12-9-13(15)7-8-14(12)11(3)4/h5,11-12,14H,6-9H2,1-4H3
InChIKey DDPLLEGPDJBLHM-UHFFFAOYSA-N
Molecular Weight 208.345 g/mol
SMILES C1(C(CCC(C1)=O)C(C)C)CC=C(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.810584