| SpectraBase Compound ID | Y2okaZFxlH |
|---|---|
| InChI | InChI=1S/C16H10ClNO4S/c17-11-1-5-13(6-2-11)23(21,22)14-7-3-12(4-8-14)18-15(19)9-10-16(18)20/h1-10H |
| InChIKey | VQQWKJCJXCCXFS-UHFFFAOYSA-N |
| Mol Weight | 347.77 g/mol |
| Molecular Formula | C16H10ClNO4S |
| Exact Mass | 347.001907 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L0edBhmzMGY |
|---|---|
| Name | 4-Chlorophenyl 4-(N-maleimido)phenyl sulphone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 347.001906676 u |
| Formula | C16H10ClNO4S |
| InChI | InChI=1S/C16H10ClNO4S/c17-11-1-5-13(6-2-11)23(21,22)14-7-3-12(4-8-14)18-15(19)9-10-16(18)20/h1-10H |
| InChIKey | VQQWKJCJXCCXFS-UHFFFAOYSA-N |
| Molecular Weight | 347.772 g/mol |
| SMILES | C=1(S(C=2C=CC(=CC2)Cl)(=O)=O)C=CC(N2C(C=CC2=O)=O)=CC1 |