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1-Benzoyl-2-thio-3-o-tolylurea
SpectraBase Compound ID L57sg3GfgAi
InChI InChI=1S/C15H14N2OS/c1-11-7-5-6-10-13(11)16-15(19)17-14(18)12-8-3-2-4-9-12/h2-10H,1H3,(H2,16,17,18,19)
InChIKey LTGMLAWCHYYTCQ-UHFFFAOYSA-N
Mol Weight 270.35 g/mol
Molecular Formula C15H14N2OS
Exact Mass 270.082684 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID g7To2vDnZg
Name 1-Benzoyl-2-thio-3-o-tolylurea
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 270.082684252 u
Formula C15H14N2OS
InChI InChI=1S/C15H14N2OS/c1-11-7-5-6-10-13(11)16-15(19)17-14(18)12-8-3-2-4-9-12/h2-10H,1H3,(H2,16,17,18,19)
InChIKey LTGMLAWCHYYTCQ-UHFFFAOYSA-N
Molecular Weight 270.350 g/mol
SMILES N(C1=C(C=CC=C1)C)C(NC(C=1C=CC=CC1)=O)=S
Spectrum/Structure Validation Score (Raman) 0.930531