SpectraBase Spectrum ID |
6MOxE59LtRf |
Name |
alpha,alpha'-bis(Diethylamino)-4-fluoro-2,6-xylenol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
282.210741659 u |
Formula |
C16H27FN2O |
InChI |
InChI=1S/C16H27FN2O/c1-5-18(6-2)11-13-9-15(17)10-14(16(13)20)12-19(7-3)8-4/h9-10,20H,5-8,11-12H2,1-4H3 |
InChIKey |
ZYXWDVOSYJBTEJ-UHFFFAOYSA-N |
Molecular Weight |
282.403 g/mol |
SMILES |
OC=1C(=CC(=CC1CN(CC)CC)F)CN(CC)CC |
Spectrum/Structure Validation Score (Raman) |
0.961097 |