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(1R,2R,5S)-1-((R)-methoxy(phenyl)methyl)-2-methyl-2-phenyl-3-oxabicyclo[3.1.0]hexane

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

(1R,2R,5S)-1-((R)-methoxy(phenyl)methyl)-2-methyl-2-phenyl-3-oxabicyclo[3.1.0]hexane
SpectraBase Compound ID 81rSKgJ1u8R
InChI InChI=1S/C20H22O2/c1-19(16-11-7-4-8-12-16)20(13-17(20)14-22-19)18(21-2)15-9-5-3-6-10-15/h3-12,17-18H,13-14H2,1-2H3/t17-,18-,19-,20-/m1/s1
InChIKey SLMGIAHPEWKNQK-UAFMIMERSA-N
Mol Weight 294.39 g/mol
Molecular Formula C20H22O2
Exact Mass 294.16198 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID E5AfPGQJtzy
Name (1R,2R,5S)-1-((R)-Methoxy(phenyl)methyl)-2-methyl-2-phenyl-3-oxabicyclo[3.1.0]hexane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 294.161979946 u
Formula C20H22O2
InChI InChI=1S/C20H22O2/c1-19(16-11-7-4-8-12-16)20(13-17(20)14-22-19)18(21-2)15-9-5-3-6-10-15/h3-12,17-18H,13-14H2,1-2H3/t17-,18-,19-,20-/m1/s1
InChIKey SLMGIAHPEWKNQK-UAFMIMERSA-N
SMILES [C@@]1(C2=CC=CC=C2)(C)[C@@]2([C@@](C=3C=CC=CC3)(OC)[H])[C@@](CO1)(C2)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.894879