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(1S,2S,5R)-2-Benzyloxy-3,5-dimethylcyclohex-3-enol

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

(1S,2S,5R)-2-Benzyloxy-3,5-dimethylcyclohex-3-enol
SpectraBase Compound ID IwpFnuuJGMv
InChI InChI=1S/C15H20O2/c1-11-8-12(2)15(14(16)9-11)17-10-13-6-4-3-5-7-13/h3-8,11,14-16H,9-10H2,1-2H3/t11-,14-,15-/m0/s1
InChIKey SPLLVZKTOUPJRR-CQDKDKBSSA-N
Mol Weight 232.32 g/mol
Molecular Formula C15H20O2
Exact Mass 232.14633 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9MUif8giJOR
Name (1S,2S,5R)-2-Benzyloxy-3,5-dimethylcyclohex-3-enol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 232.146329882 u
Formula C15H20O2
InChI InChI=1S/C15H20O2/c1-11-8-12(2)15(14(16)9-11)17-10-13-6-4-3-5-7-13/h3-8,11,14-16H,9-10H2,1-2H3/t11-,14-,15-/m0/s1
InChIKey SPLLVZKTOUPJRR-CQDKDKBSSA-N
Molecular Weight 232.323 g/mol
SMILES C1[C@](O)([C@@](OCC2=CC=CC=C2)(C(C)=C[C@@]1(C)[H])[H])[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.842291