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(2S)-1-(2,3-Dimethylphenoxy)-2,3-dihydroxypropane

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

(2S)-1-(2,3-Dimethylphenoxy)-2,3-dihydroxypropane
SpectraBase Compound ID FWjubJR8Ca0
InChI InChI=1S/C11H16O3/c1-8-4-3-5-11(9(8)2)14-7-10(13)6-12/h3-5,10,12-13H,6-7H2,1-2H3/t10-/m0/s1
InChIKey WDWFIXABEHDYHZ-JTQLQIEISA-N
Mol Weight 196.25 g/mol
Molecular Formula C11H16O3
Exact Mass 196.109944 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GQLQQGDqLNK
Name (2S)-1-(2,3-Dimethylphenoxy)-2,3-dihydroxypropane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 196.109944372 u
Formula C11H16O3
InChI InChI=1S/C11H16O3/c1-8-4-3-5-11(9(8)2)14-7-10(13)6-12/h3-5,10,12-13H,6-7H2,1-2H3/t10-/m0/s1
InChIKey WDWFIXABEHDYHZ-JTQLQIEISA-N
Molecular Weight 196.246 g/mol
SMILES C=1(C(OC[C@@](O)(CO)[H])=CC=CC1C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.932758