SpectraBase Compound ID | GxdGnkAatZB |
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InChI | InChI=1S/C11H10N2S/c12-11(14)13-10-6-5-8-3-1-2-4-9(8)7-10/h1-7H,(H3,12,13,14) |
InChIKey | JCGVEGFEGJLZDW-UHFFFAOYSA-N |
Mol Weight | 202.27 g/mol |
Molecular Formula | C11H10N2S |
Exact Mass | 202.05647 g/mol |
SpectraBase Spectrum ID | 3XupmsUEMG7 |
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Name | 1-(2-Naphthyl)-2-thiourea |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 202.056469504 u |
Formula | C11H10N2S |
InChI | InChI=1S/C11H10N2S/c12-11(14)13-10-6-5-8-3-1-2-4-9(8)7-10/h1-7H,(H3,12,13,14) |
InChIKey | JCGVEGFEGJLZDW-UHFFFAOYSA-N |
Molecular Weight | 202.275 g/mol |
SMILES | N(C=1C=CC=2C=CC=CC2C1)C(N)=S |
Spectrum/Structure Validation Score (Raman) | 0.935496 |