| SpectraBase Compound ID | BMOB2ujfeCW |
|---|---|
| InChI | InChI=1S/C15H11NO4S/c17-15(10-11-21-14-4-2-1-3-5-14)20-13-8-6-12(7-9-13)16(18)19/h1-11H/b11-10+ |
| InChIKey | LFEGXLBDCFBJFE-ZHACJKMWSA-N |
| Mol Weight | 301.32 g/mol |
| Molecular Formula | C15H11NO4S |
| Exact Mass | 301.040879 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | jFzwMFuZJe |
|---|---|
| Name | p-Nitrophenyl 3-phenylsulfanylacrylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 301.040879008 u |
| Formula | C15H11NO4S |
| InChI | InChI=1S/C15H11NO4S/c17-15(10-11-21-14-4-2-1-3-5-14)20-13-8-6-12(7-9-13)16(18)19/h1-11H/b11-10+ |
| InChIKey | LFEGXLBDCFBJFE-ZHACJKMWSA-N |
| Molecular Weight | 301.316 g/mol |
| SMILES | C(\C=C\SC=1C=CC=CC1)(=O)OC=1C=CC(=CC1)N(=O)=O |