SpectraBase Compound ID | JRnNNlPEFtd |
---|---|
InChI | InChI=1S/C11H14N2S/c1-2-12-8-9-13(11(12)14)10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3 |
InChIKey | AGKZBWFBYBRNQX-UHFFFAOYSA-N |
Mol Weight | 206.31 g/mol |
Molecular Formula | C11H14N2S |
Exact Mass | 206.08777 g/mol |
SpectraBase Spectrum ID | GjgCrgyzNAB |
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Name | 1-Ethyl-3-phenyl-2-imidazolidinethione |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 206.087769633 u |
Formula | C11H14N2S |
InChI | InChI=1S/C11H14N2S/c1-2-12-8-9-13(11(12)14)10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3 |
InChIKey | AGKZBWFBYBRNQX-UHFFFAOYSA-N |
Molecular Weight | 206.307 g/mol |
SMILES | C1(N(CCN1CC)C1=CC=CC=C1)=S |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.897116 |