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(2S,3S)-2,3-Dimethyl-5-(tetrahydropyran-2-yloxy)-1-pentanol

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

(2S,3S)-2,3-Dimethyl-5-(tetrahydropyran-2-yloxy)-1-pentanol
SpectraBase Compound ID 6BYVfUULh23
InChI InChI=1S/C12H24O3/c1-10(11(2)9-13)6-8-15-12-5-3-4-7-14-12/h10-13H,3-9H2,1-2H3/t10-,11+,12?/m0/s1
InChIKey CCROVMKWOJEYQX-WIKAKEFZSA-N
Mol Weight 216.32 g/mol
Molecular Formula C12H24O3
Exact Mass 216.172545 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DNy2gW4qiIO
Name (2S,3S)-2,3-Dimethyl-5-(tetrahydropyran-2-yloxy)-1-pentanol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 216.172544630 u
Formula C12H24O3
InChI InChI=1S/C12H24O3/c1-10(11(2)9-13)6-8-15-12-5-3-4-7-14-12/h10-13H,3-9H2,1-2H3/t10-,11+,12?/m0/s1
InChIKey CCROVMKWOJEYQX-WIKAKEFZSA-N
Molecular Weight 216.321 g/mol
SMILES C1(OCCCC1)OCC[C@@]([C@@](CO)(C)[H])(C)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.871146