| SpectraBase Compound ID | 9gC0geEdFj5 |
|---|---|
| InChI | InChI=1S/C14H14N2O3S/c1-3-18-14(17)11-8(2)19-13(16)9(7-15)12(11)10-5-4-6-20-10/h4-6,12H,3,16H2,1-2H3 |
| InChIKey | NYBMJRNRDGDXAX-UHFFFAOYSA-N |
| Mol Weight | 290.34 g/mol |
| Molecular Formula | C14H14N2O3S |
| Exact Mass | 290.072513 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JR4f3O4pbJd |
|---|---|
| Name | 2-Amino-3-cyano-4-(2-thienyl)-5-ethoxycarbonyl-6-methyl-4H-pyran |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 290.072513490 u |
| Formula | C14H14N2O3S |
| InChI | InChI=1S/C14H14N2O3S/c1-3-18-14(17)11-8(2)19-13(16)9(7-15)12(11)10-5-4-6-20-10/h4-6,12H,3,16H2,1-2H3 |
| InChIKey | NYBMJRNRDGDXAX-UHFFFAOYSA-N |
| Molecular Weight | 290.337 g/mol |
| SMILES | NC=1OC(=C(C(C1C#N)C1=CC=CS1)C(OCC)=O)C |