| SpectraBase Spectrum ID |
HD5XLKVqiAF |
| Name |
1-Fluoranyl-4-[3-(4-fluorophenyl)-2,3-dimethyl-butan-2-yl]benzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
274.153306970 u |
| Formula |
C18H20F2 |
| InChI |
InChI=1S/C18H20F2/c1-17(2,13-5-9-15(19)10-6-13)18(3,4)14-7-11-16(20)12-8-14/h5-12H,1-4H3 |
| InChIKey |
KLPZYKMREYWRCX-UHFFFAOYSA-N |
| Molecular Weight |
274.355 g/mol |
| SMILES |
C(C(C1=CC=C(C=C1)F)(C)C)(C1=CC=C(C=C1)F)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.882964 |
![1-Fluoranyl-4-[3-(4-fluorophenyl)-2,3-dimethyl-butan-2-yl]benzene](/api/spectrum/HD5XLKVqiAF/structure.png?h=300&w=458 "1-Fluoranyl-4-[3-(4-fluorophenyl)-2,3-dimethyl-butan-2-yl]benzene")
