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5-Hexen-2-one, 4-hydroxy-3-methyl-6-phenyl-, (R*,S*)-

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

5-Hexen-2-one, 4-hydroxy-3-methyl-6-phenyl-, (R*,S*)-
SpectraBase Compound ID CG6wv7f91aS
InChI InChI=1S/C13H16O2/c1-10(11(2)14)13(15)9-8-12-6-4-3-5-7-12/h3-10,13,15H,1-2H3/b9-8+
InChIKey FDGLVDIVRXFBNV-CMDGGOBGSA-N
Mol Weight 204.27 g/mol
Molecular Formula C13H16O2
Exact Mass 204.11503 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FNiH1rLrJsT
Name 5-Hexen-2-one, 4-hydroxy-3-methyl-6-phenyl-, (R*,S*)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 204.115029753 u
Formula C13H16O2
InChI InChI=1S/C13H16O2/c1-10(11(2)14)13(15)9-8-12-6-4-3-5-7-12/h3-10,13,15H,1-2H3/b9-8+
InChIKey FDGLVDIVRXFBNV-CMDGGOBGSA-N
Molecular Weight 204.269 g/mol
SMILES C=1(\C=C\C(C(C(=O)C)C)O)C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.871829