| SpectraBase Compound ID | 8aOb14jxufC |
|---|---|
| InChI | InChI=1S/C16H21NO5/c1-4-21-15(19)10-17(11-16(20)22-5-2)14-8-6-13(7-9-14)12(3)18/h6-9H,4-5,10-11H2,1-3H3 |
| InChIKey | NFLDLKBCMNFWKZ-UHFFFAOYSA-N |
| Mol Weight | 307.35 g/mol |
| Molecular Formula | C16H21NO5 |
| Exact Mass | 307.141973 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ib4ZCGSXAmQ |
|---|---|
| Name | Aminobenzene, 4-acetyl-N,N-bis(ethoxycarbonylmethyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 307.141972775 u |
| Formula | C16H21NO5 |
| InChI | InChI=1S/C16H21NO5/c1-4-21-15(19)10-17(11-16(20)22-5-2)14-8-6-13(7-9-14)12(3)18/h6-9H,4-5,10-11H2,1-3H3 |
| InChIKey | NFLDLKBCMNFWKZ-UHFFFAOYSA-N |
| Molecular Weight | 307.346 g/mol |
| SMILES | C1=C(C=CC(=C1)C(=O)C)N(CC(OCC)=O)CC(OCC)=O |