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1-(p-Anisoyl)-3-(2,6-difluorophenyl)-2-thiourea

View entire compound with spectra: 2 NMR, 1 FTIR, 1 Raman, and 1 UV-Vis

1-(p-Anisoyl)-3-(2,6-difluorophenyl)-2-thiourea
SpectraBase Compound ID hdWIq6wS8R
InChI InChI=1S/C15H12F2N2O2S/c1-21-10-7-5-9(6-8-10)14(20)19-15(22)18-13-11(16)3-2-4-12(13)17/h2-8H,1H3,(H2,18,19,20,22)
InChIKey OMHRRKXRESPHCI-UHFFFAOYSA-N
Mol Weight 322.33 g/mol
Molecular Formula C15H12F2N2O2S
Exact Mass 322.058755 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID JtIZXgmPsDF
Name 1-(p-Anisoyl)-3-(2,6-difluorophenyl)-2-thiourea
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 322.058755132 u
Formula C15H12F2N2O2S
InChI InChI=1S/C15H12F2N2O2S/c1-21-10-7-5-9(6-8-10)14(20)19-15(22)18-13-11(16)3-2-4-12(13)17/h2-8H,1H3,(H2,18,19,20,22)
InChIKey OMHRRKXRESPHCI-UHFFFAOYSA-N
Molecular Weight 322.330 g/mol
SMILES N(C1=C(C=CC=C1F)F)C(NC(C=1C=CC(=CC1)OC)=O)=S
Spectrum/Structure Validation Score (Raman) 0.782678