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4-Fluoro-.alpha.-methylbenzyl alcohol, 3-methylbutyl ether

View entire compound with spectra: 1 NMR, and 1 FTIR

4-Fluoro-.alpha.-methylbenzyl alcohol, 3-methylbutyl ether
SpectraBase Compound ID 8KtlDAM4kvO
InChI InChI=1S/C13H19FO/c1-10(2)8-9-15-11(3)12-4-6-13(14)7-5-12/h4-7,10-11H,8-9H2,1-3H3
InChIKey LCWZJZIHIKOKIB-UHFFFAOYSA-N
Mol Weight 210.29 g/mol
Molecular Formula C13H19FO
Exact Mass 210.141993 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LqC1vFbU3wU
Name 4-Fluoro-.alpha.-methylbenzyl alcohol, 3-methylbutyl ether
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 210.141993394 u
Formula C13H19FO
InChI InChI=1S/C13H19FO/c1-10(2)8-9-15-11(3)12-4-6-13(14)7-5-12/h4-7,10-11H,8-9H2,1-3H3
InChIKey LCWZJZIHIKOKIB-UHFFFAOYSA-N
Molecular Weight 210.292 g/mol
SMILES C1(=CC=C(C=C1)F)C(OCCC(C)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.921362