SpectraBase Compound ID | IcIVhqdUZqL |
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InChI | InChI=1S/C11H11NS/c1-12-9-6-2-4-8-5-3-7-10(13)11(8)9/h2-7,12-13H,1H3 |
InChIKey | RMHLWZUSLGSKDB-UHFFFAOYSA-N |
Mol Weight | 189.28 g/mol |
Molecular Formula | C11H11NS |
Exact Mass | 189.061221 g/mol |
SpectraBase Spectrum ID | IbjNwS4kGbu |
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Name | 8-(Methylamino)-1-naphthalenethiol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 189.061220532 u |
Formula | C11H11NS |
InChI | InChI=1S/C11H11NS/c1-12-9-6-2-4-8-5-3-7-10(13)11(8)9/h2-7,12-13H,1H3 |
InChIKey | RMHLWZUSLGSKDB-UHFFFAOYSA-N |
Molecular Weight | 189.276 g/mol |
SMILES | C=1(C=CC=C2C=CC=C(C12)NC)S |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.887261 |