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1-Cyclohexanone,2-[1-(2-naphthyl)methylidene]
SpectraBase Compound ID H9VbYu2caWX
InChI InChI=1S/C17H16O/c18-17-8-4-3-7-16(17)12-13-9-10-14-5-1-2-6-15(14)11-13/h1-2,5-6,9-12H,3-4,7-8H2/b16-12-
InChIKey KQEXTBFMYBRQLX-VBKFSLOCSA-N
Mol Weight 236.31 g/mol
Molecular Formula C17H16O
Exact Mass 236.120115 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID L72hWIsMCUL
Name 1-Cyclohexanone,2-[1-(2-naphthyl)methylidene]
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 236.120115134 u
Formula C17H16O
InChI InChI=1S/C17H16O/c18-17-8-4-3-7-16(17)12-13-9-10-14-5-1-2-6-15(14)11-13/h1-2,5-6,9-12H,3-4,7-8H2/b16-12-
InChIKey KQEXTBFMYBRQLX-VBKFSLOCSA-N
Molecular Weight 236.314 g/mol
SMILES c1ccc2c(c1)ccc(c2)\C=C\1CCCCC1=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.805058