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3-Buten-2-one, 4-(1,2,6,6-tetramethyl-2-cyclohexen-1-yl)-

View entire compound with spectra: 1 FTIR

3-Buten-2-one, 4-(1,2,6,6-tetramethyl-2-cyclohexen-1-yl)-
SpectraBase Compound ID 8Ggvsd7s0cT
InChI InChI=1S/C14H22O/c1-11-7-6-9-13(3,4)14(11,5)10-8-12(2)15/h7-8,10H,6,9H2,1-5H3/b10-8+
InChIKey MOLZHSROFREFLG-CSKARUKUSA-N
Mol Weight 206.33 g/mol
Molecular Formula C14H22O
Exact Mass 206.167065 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CzdkkqJ7k7G
Name 3-Buten-2-one, 4-(1,2,6,6-tetramethyl-2-cyclohexen-1-yl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 206.167065327 u
Formula C14H22O
InChI InChI=1S/C14H22O/c1-11-7-6-9-13(3,4)14(11,5)10-8-12(2)15/h7-8,10H,6,9H2,1-5H3/b10-8+
InChIKey MOLZHSROFREFLG-CSKARUKUSA-N
Molecular Weight 206.329 g/mol
SMILES C1CC(C(C(=C1)C)(C)\C=C\C(C)=O)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.920479