| SpectraBase Compound ID | LGfmm07ud2c |
|---|---|
| InChI | InChI=1S/C8H9N3OS/c9-8(13)11-10-5-6-1-3-7(12)4-2-6/h1-5,12H,(H3,9,11,13)/b10-5+ |
| InChIKey | IKDRFCOUGSBGNI-BJMVGYQFSA-N |
| Mol Weight | 195.24 g/mol |
| Molecular Formula | C8H9N3OS |
| Exact Mass | 195.046633 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | BsuyhXRaMlZ |
|---|---|
| Name | 4-Hydroxyphenyl-thiosemicarbazone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 195.046633095 u |
| Formula | C8H9N3OS |
| InChI | InChI=1S/C8H9N3OS/c9-8(13)11-10-5-6-1-3-7(12)4-2-6/h1-5,12H,(H3,9,11,13)/b10-5+ |
| InChIKey | IKDRFCOUGSBGNI-BJMVGYQFSA-N |
| Molecular Weight | 195.240 g/mol |
| SMILES | C(N)(=S)N\N=C\C1=CC=C(O)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.839034 |