SpectraBase Compound ID | IEdCVKptop8 |
---|---|
InChI | InChI=1S/C10H14N2S/c1-3-11-10(13)12-9-6-4-5-8(2)7-9/h4-7H,3H2,1-2H3,(H2,11,12,13) |
InChIKey | YDUGLSQPIVEIMP-UHFFFAOYSA-N |
Mol Weight | 194.3 g/mol |
Molecular Formula | C10H14N2S |
Exact Mass | 194.08777 g/mol |
SpectraBase Spectrum ID | ClRo0dfq2fV |
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Name | 1-Ethyl-2-thio-3-m-tolylurea |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 194.087769633 u |
Formula | C10H14N2S |
InChI | InChI=1S/C10H14N2S/c1-3-11-10(13)12-9-6-4-5-8(2)7-9/h4-7H,3H2,1-2H3,(H2,11,12,13) |
InChIKey | YDUGLSQPIVEIMP-UHFFFAOYSA-N |
SMILES | N(C1=CC=CC(=C1)C)C(NCC)=S |
Spectrum/Structure Validation Score (Raman) | 0.975558 |