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2-Ethenyl-2-(1-oxo-2-phenylethyl)cyclohexan-1-ol
SpectraBase Compound ID 7qd7G3vdidH
InChI InChI=1S/C16H20O2/c1-2-16(11-7-6-10-14(16)17)15(18)12-13-8-4-3-5-9-13/h2-5,8-9,14,17H,1,6-7,10-12H2/t14-,16+/m0/s1
InChIKey DSIQYPOOAZEAJT-GOEBONIOSA-N
Mol Weight 244.33 g/mol
Molecular Formula C16H20O2
Exact Mass 244.14633 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3M7HQ32fx51
Name 2-Ethenyl-2-(1-oxo-2-phenylethyl)cyclohexan-1-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 244.146329882 u
Formula C16H20O2
InChI InChI=1S/C16H20O2/c1-2-16(11-7-6-10-14(16)17)15(18)12-13-8-4-3-5-9-13/h2-5,8-9,14,17H,1,6-7,10-12H2/t14-,16+/m0/s1
InChIKey DSIQYPOOAZEAJT-GOEBONIOSA-N
Molecular Weight 244.334 g/mol
SMILES [C@]1(C(CC2=CC=CC=C2)=O)(C=C)[C@@](O)(CCCC1)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.842715