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(1R,3S)-3-Phenyl-1-methoxycyclohexane

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 MS (GC)

(1R,3S)-3-Phenyl-1-methoxycyclohexane
SpectraBase Compound ID Hrn8S2YCizb
InChI InChI=1S/C13H18O/c1-14-13-9-5-8-12(10-13)11-6-3-2-4-7-11/h2-4,6-7,12-13H,5,8-10H2,1H3/t12-,13+/m0/s1
InChIKey FZASMYFOEZHUTA-QWHCGFSZSA-N
Mol Weight 190.29 g/mol
Molecular Formula C13H18O
Exact Mass 190.135765 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 11IhEL9Y0dP
Name (1R,3S)-3-Phenyl-1-methoxycyclohexane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 190.135765199 u
Formula C13H18O
InChI InChI=1S/C13H18O/c1-14-13-9-5-8-12(10-13)11-6-3-2-4-7-11/h2-4,6-7,12-13H,5,8-10H2,1H3/t12-,13+/m0/s1
InChIKey FZASMYFOEZHUTA-QWHCGFSZSA-N
Molecular Weight 190.286 g/mol
SMILES [C@@]1(C[C@](OC)(CCC1)[H])(C=1C=CC=CC1)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.904718