| SpectraBase Compound ID | JtuncqFwY9M |
|---|---|
| InChI | InChI=1S/C18H13NO3/c20-17(11-10-13-6-2-1-3-7-13)19-15-12-14-8-4-5-9-16(14)22-18(15)21/h1-12H,(H,19,20) |
| InChIKey | JQWZVTPRNPSAKC-UHFFFAOYSA-N |
| Mol Weight | 291.31 g/mol |
| Molecular Formula | C18H13NO3 |
| Exact Mass | 291.089543 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1rOyvumwmhW |
|---|---|
| Name | 3-Cinnamamidocoumarin |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 291.089543280 u |
| Formula | C18H13NO3 |
| InChI | InChI=1S/C18H13NO3/c20-17(11-10-13-6-2-1-3-7-13)19-15-12-14-8-4-5-9-16(14)22-18(15)21/h1-12H,(H,19,20) |
| InChIKey | JQWZVTPRNPSAKC-UHFFFAOYSA-N |
| Molecular Weight | 291.306 g/mol |
| SMILES | N(C=1C(OC=2C=CC=CC2C1)=O)C(C=CC=1C=CC=CC1)=O |