![N-[2-Acetamidoethylthio]phthalimide](/api/spectrum/KWNphwtsr7j/structure.png?h=300&w=458 "N-[2-Acetamidoethylthio]phthalimide")
| SpectraBase Compound ID | FVIgjdSTU2g |
|---|---|
| InChI | InChI=1S/C12H12N2O3S/c1-8(15)13-6-7-18-14-11(16)9-4-2-3-5-10(9)12(14)17/h2-5H,6-7H2,1H3,(H,13,15) |
| InChIKey | XZJJFDJSAXIMAP-UHFFFAOYSA-N |
| Mol Weight | 264.3 g/mol |
| Molecular Formula | C12H12N2O3S |
| Exact Mass | 264.056863 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KWNphwtsr7j |
|---|---|
| Name | N-[2-Acetamidoethylthio]phthalimide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 264.056863425 u |
| Formula | C12H12N2O3S |
| InChI | InChI=1S/C12H12N2O3S/c1-8(15)13-6-7-18-14-11(16)9-4-2-3-5-10(9)12(14)17/h2-5H,6-7H2,1H3,(H,13,15) |
| InChIKey | XZJJFDJSAXIMAP-UHFFFAOYSA-N |
| SMILES | C1=CC=CC2=C1C(N(C2=O)SCCNC(C)=O)=O |