SpectraBase Spectrum ID |
2UzFROvCiVl |
Name |
Ether, [1-(p-fluorophenyl)ethyl] 3-hydroxy-2-butyl |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
212.121257948 u |
Formula |
C12H17FO2 |
InChI |
InChI=1S/C12H17FO2/c1-8(14)9(2)15-10(3)11-4-6-12(13)7-5-11/h4-10,14H,1-3H3 |
InChIKey |
YLIQBRMTWVHLPV-UHFFFAOYSA-N |
Molecular Weight |
212.264 g/mol |
SMILES |
CC(C(C)O)OC(C)C1=CC=C(F)C=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.910966 |