| SpectraBase Compound ID | DwY8pvz619N |
|---|---|
| InChI | InChI=1S/C18H15NO3S/c20-17(22-12-6-9-14-7-2-1-3-8-14)13-19-15-10-4-5-11-16(15)23-18(19)21/h1-11H,12-13H2/b9-6- |
| InChIKey | ADJDPPSQXCVBHE-TWGQIWQCSA-N |
| Mol Weight | 325.38 g/mol |
| Molecular Formula | C18H15NO3S |
| Exact Mass | 325.077265 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2MssWK1Sbnb |
|---|---|
| Name | Cinnamyl (2-oxo-1,3-benzothiazol-3(2H)-yl)acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 325.077264518 u |
| Formula | C18H15NO3S |
| InChI | InChI=1S/C18H15NO3S/c20-17(22-12-6-9-14-7-2-1-3-8-14)13-19-15-10-4-5-11-16(15)23-18(19)21/h1-11H,12-13H2/b9-6- |
| InChIKey | ADJDPPSQXCVBHE-TWGQIWQCSA-N |
| Molecular Weight | 325.382 g/mol |
| SMILES | C(N1C2=CC=CC=C2SC1=O)C(OC\C=C/C1=CC=CC=C1)=O |