SpectraBase Spectrum ID |
LpPN8d6n4PX |
Name |
4-Fluorophenethyl alcohol, 1-methylpropyl 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/c1-3-10(2)14-9-8-11-4-6-12(13)7-5-11/h4-7,10H,3,8-9H2,1-2H3 |
InChIKey |
COKJWSRWDSRMQB-UHFFFAOYSA-N |
Molecular Weight |
196.265 g/mol |
SMILES |
C1(=CC=C(C=C1)F)CCOC(CC)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.942718 |