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(4R,5R)-4-(2-methoxyphenyl)-2,2-dimethyl-5-phenyl-1,3-dioxolane
SpectraBase Compound ID LHrRBiRQhXc
InChI InChI=1S/C18H20O3/c1-18(2)20-16(13-9-5-4-6-10-13)17(21-18)14-11-7-8-12-15(14)19-3/h4-12,16-17H,1-3H3/t16-,17-/m1/s1
InChIKey APVYEYOXOSGOOM-IAGOWNOFSA-N
Mol Weight 284.36 g/mol
Molecular Formula C18H20O3
Exact Mass 284.141245 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID IgHMG3KMrvK
Name (4R,5R)-4-(2-Methoxyphenyl)-2,2-dimethyl-5-phenyl-1,3-dioxolane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 284.141244501 u
Formula C18H20O3
InChI InChI=1S/C18H20O3/c1-18(2)20-16(13-9-5-4-6-10-13)17(21-18)14-11-7-8-12-15(14)19-3/h4-12,16-17H,1-3H3/t16-,17-/m1/s1
InChIKey APVYEYOXOSGOOM-IAGOWNOFSA-N
SMILES [C@@]1([C@](OC(O1)(C)C)(C1=CC=CC=C1)[H])(C=1C(OC)=CC=CC1)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.813521