SpectraBase Compound ID | 2GydvxEQF4l |
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InChI | InChI=1S/C10H14N2S/c1-7(2)8-3-5-9(6-4-8)12-10(11)13/h3-7H,1-2H3,(H3,11,12,13) |
InChIKey | HYJQJTWSGAJMDV-UHFFFAOYSA-N |
Mol Weight | 194.3 g/mol |
Molecular Formula | C10H14N2S |
Exact Mass | 194.08777 g/mol |
SpectraBase Spectrum ID | 2B1TrcP1RVA |
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Name | 1-(p-Cumenyl)-2-thiourea |
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/c1-7(2)8-3-5-9(6-4-8)12-10(11)13/h3-7H,1-2H3,(H3,11,12,13) |
InChIKey | HYJQJTWSGAJMDV-UHFFFAOYSA-N |
SMILES | N(C1=CC=C(C=C1)C(C)C)C(N)=S |
Spectrum/Structure Validation Score (Raman) | 0.976363 |