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4-Fluoro-.alpha.-methylbenzyl alcohol, N-butyl ether

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4-Fluoro-.alpha.-methylbenzyl alcohol, N-butyl ether
SpectraBase Compound ID ZulN4oqMSk
InChI InChI=1S/C12H17FO/c1-3-4-9-14-10(2)11-5-7-12(13)8-6-11/h5-8,10H,3-4,9H2,1-2H3
InChIKey WGRJDHONBADCTB-UHFFFAOYSA-N
Mol Weight 196.27 g/mol
Molecular Formula C12H17FO
Exact Mass 196.126343 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9Sq80daxrZ
Name 4-Fluoro-.alpha.-methylbenzyl alcohol, N-butyl ether
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 196.126343329 u
Formula C12H17FO
InChI InChI=1S/C12H17FO/c1-3-4-9-14-10(2)11-5-7-12(13)8-6-11/h5-8,10H,3-4,9H2,1-2H3
InChIKey WGRJDHONBADCTB-UHFFFAOYSA-N
Molecular Weight 196.265 g/mol
SMILES C1(=CC=C(C=C1)F)C(OCCCC)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.879855