SpectraBase Spectrum ID |
AmstGEMcocd |
Name |
(2,3,3-Trifluoro-4-phenylbutyl)benzene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
264.112584972 u |
Formula |
C16H15F3 |
InChI |
InChI=1S/C16H15F3/c17-15(11-13-7-3-1-4-8-13)16(18,19)12-14-9-5-2-6-10-14/h1-10,15H,11-12H2 |
InChIKey |
GJANQJKUEGMHNT-UHFFFAOYSA-N |
Molecular Weight |
264.291 g/mol |
SMILES |
C(CC1=CC=CC=C1)(C(CC1=CC=CC=C1)F)(F)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.804311 |