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3-[4-Fluoranyl-2-[oxidanyl(diphenyl)methyl]phenyl]-1,1-dimethyl-urea
SpectraBase Compound ID L1PuI8r8BH4
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
Mol Weight 364.42 g/mol
Molecular Formula C22H21FN2O2
Exact Mass 364.158706 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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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