| SpectraBase Compound ID | GE7e0e2sfE9 |
|---|---|
| InChI | InChI=1S/C18H16N2O8/c21-17(27-11-13-5-1-3-7-15(13)19(23)24)9-10-18(22)28-12-14-6-2-4-8-16(14)20(25)26/h1-8H,9-12H2 |
| InChIKey | UACDKYUTVLNPJH-UHFFFAOYSA-N |
| Mol Weight | 388.33 g/mol |
| Molecular Formula | C18H16N2O8 |
| Exact Mass | 388.090665 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ApIT12Iecd3 |
|---|---|
| Name | Succinic acid, di(2-nitrobenzyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 388.090665475 u |
| Formula | C18H16N2O8 |
| InChI | InChI=1S/C18H16N2O8/c21-17(27-11-13-5-1-3-7-15(13)19(23)24)9-10-18(22)28-12-14-6-2-4-8-16(14)20(25)26/h1-8H,9-12H2 |
| InChIKey | UACDKYUTVLNPJH-UHFFFAOYSA-N |
| Molecular Weight | 388.332 g/mol |
| SMILES | C1=CC=C(C(=C1)N(=O)=O)COC(=O)CCC(OCC1=CC=CC=C1N(=O)=O)=O |