SpectraBase Spectrum ID |
BLwpT0boYe8 |
Name |
3-[4-Fluoranyl-2-[oxidanyl(diphenyl)methyl]phenyl]-1,1-dimethyl-urea |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
364.158706085 u |
Formula |
C22H21FN2O2 |
InChI |
InChI=1S/C22H21FN2O2/c1-25(2)21(26)24-20-14-13-18(23)15-19(20)22(27,16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-15,27H,1-2H3,(H,24,26) |
InChIKey |
KVGWUORVUNFEBE-UHFFFAOYSA-N |
Molecular Weight |
364.420 g/mol |
SMILES |
C=1(C(C2=CC=CC=C2)(C=2C=CC=CC2)O)C(NC(N(C)C)=O)=CC=C(C1)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.919378 |