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(2R)-3-(Benzyloxy)-2-butyl-1-propanol
SpectraBase Compound ID CYih559SzzR
InChI InChI=1S/C14H22O2/c1-2-3-7-14(10-15)12-16-11-13-8-5-4-6-9-13/h4-6,8-9,14-15H,2-3,7,10-12H2,1H3/t14-/m1/s1
InChIKey GNLZSOCECFWNCY-CQSZACIVSA-N
Mol Weight 222.33 g/mol
Molecular Formula C14H22O2
Exact Mass 222.16198 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JakqzReMqqn
Name (2R)-3-(Benzyloxy)-2-butyl-1-propanol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 222.161979946 u
Formula C14H22O2
InChI InChI=1S/C14H22O2/c1-2-3-7-14(10-15)12-16-11-13-8-5-4-6-9-13/h4-6,8-9,14-15H,2-3,7,10-12H2,1H3/t14-/m1/s1
InChIKey GNLZSOCECFWNCY-CQSZACIVSA-N
Molecular Weight 222.328 g/mol
SMILES C(OCC=1C=CC=CC1)[C@@](CO)(CCCC)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.927096