| SpectraBase Compound ID | 2wzzJEvD7r7 |
|---|---|
| InChI | InChI=1S/C10H7NO3S/c1-15-10(14)11-8(12)6-4-2-3-5-7(6)9(11)13/h2-5H,1H3 |
| InChIKey | FJTFEZGZZSIVEY-UHFFFAOYSA-N |
| Mol Weight | 221.23 g/mol |
| Molecular Formula | C10H7NO3S |
| Exact Mass | 221.014664 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | H6uuvzimSSZ |
|---|---|
| Name | Phthalimide, N-(methylthio)carbonyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 221.014664260 u |
| Formula | C10H7NO3S |
| InChI | InChI=1S/C10H7NO3S/c1-15-10(14)11-8(12)6-4-2-3-5-7(6)9(11)13/h2-5H,1H3 |
| InChIKey | FJTFEZGZZSIVEY-UHFFFAOYSA-N |
| Molecular Weight | 221.230 g/mol |
| SMILES | C1(=O)N(C(=O)SC)C(C=2C1=CC=CC2)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.902899 |