![[(5-Nitro-o-anisidino)methylene]malonic acid, diethyl ester](/api/spectrum/AK7JgYqhyPM/structure.png?h=300&w=458 "[(5-Nitro-o-anisidino)methylene]malonic acid, diethyl ester")
| SpectraBase Compound ID | IvgpluhgzOD |
|---|---|
| InChI | InChI=1S/C15H18N2O7/c1-4-23-14(18)11(15(19)24-5-2)9-16-12-8-10(17(20)21)6-7-13(12)22-3/h6-9,16H,4-5H2,1-3H3 |
| InChIKey | SVWVDXBPVKBSCS-UHFFFAOYSA-N |
| Mol Weight | 338.32 g/mol |
| Molecular Formula | C15H18N2O7 |
| Exact Mass | 338.111401 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AK7JgYqhyPM |
|---|---|
| Name | [(5-Nitro-o-anisidino)methylene]malonic acid, diethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 338.111400921 u |
| Formula | C15H18N2O7 |
| InChI | InChI=1S/C15H18N2O7/c1-4-23-14(18)11(15(19)24-5-2)9-16-12-8-10(17(20)21)6-7-13(12)22-3/h6-9,16H,4-5H2,1-3H3 |
| InChIKey | SVWVDXBPVKBSCS-UHFFFAOYSA-N |
| Molecular Weight | 338.316 g/mol |
| SMILES | N(=O)(=O)C=1C=C(C(=CC1)OC)NC=C(C(OCC)=O)C(OCC)=O |