| SpectraBase Compound ID | DrcnTHvA0Zz |
|---|---|
| InChI | InChI=1S/C16H16N2O6/c19-17(20)13-5-3-7-15(11-13)23-9-1-2-10-24-16-8-4-6-14(12-16)18(21)22/h3-8,11-12H,1-2,9-10H2 |
| InChIKey | QPRWHRQOHBUZMI-UHFFFAOYSA-N |
| Mol Weight | 332.31 g/mol |
| Molecular Formula | C16H16N2O6 |
| Exact Mass | 332.100836 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HC52YZRp7iL |
|---|---|
| Name | 1,4-bis-m-Nitrophenoxybutane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 332.100836237 u |
| Formula | C16H16N2O6 |
| InChI | InChI=1S/C16H16N2O6/c19-17(20)13-5-3-7-15(11-13)23-9-1-2-10-24-16-8-4-6-14(12-16)18(21)22/h3-8,11-12H,1-2,9-10H2 |
| InChIKey | QPRWHRQOHBUZMI-UHFFFAOYSA-N |
| Molecular Weight | 332.312 g/mol |
| SMILES | C(COC1=CC=CC(N(=O)=O)=C1)CCOC=1C=C(N(=O)=O)C=CC1 |