SpectraBase Spectrum ID |
60j3RzGajJm |
Name |
Benzene, 1-fluoro-4-[(5-phenoxypentyl)oxy]- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
274.136908013 u |
Formula |
C17H19FO2 |
InChI |
InChI=1S/C17H19FO2/c18-15-9-11-17(12-10-15)20-14-6-2-5-13-19-16-7-3-1-4-8-16/h1,3-4,7-12H,2,5-6,13-14H2 |
InChIKey |
MBPHSULHJDEJMT-UHFFFAOYSA-N |
Molecular Weight |
274.335 g/mol |
SMILES |
C1(F)=CC=C(C=C1)OCCCCCOC=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.819341 |