SpectraBase Spectrum ID |
1TFu78LEA3N |
Name |
4-Fluorophenethyl alcohol, 2-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/c1-3-11(2)10-15-9-8-12-4-6-13(14)7-5-12/h4-7,11H,3,8-10H2,1-2H3 |
InChIKey |
JGJUSCCHTRNXKF-UHFFFAOYSA-N |
Molecular Weight |
210.292 g/mol |
SMILES |
C1(=CC=C(C=C1)F)CCOCC(CC)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.899278 |