| SpectraBase Compound ID | 7uxMPgD3nod |
|---|---|
| InChI | InChI=1S/C17H18N2O6/c20-18(21)14-6-4-8-16(12-14)24-10-2-1-3-11-25-17-9-5-7-15(13-17)19(22)23/h4-9,12-13H,1-3,10-11H2 |
| InChIKey | WCJSSULXVRRUJR-UHFFFAOYSA-N |
| Mol Weight | 346.34 g/mol |
| Molecular Formula | C17H18N2O6 |
| Exact Mass | 346.116486 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8Iy8ojfvlCg |
|---|---|
| Name | 1,5-bis(m-Nitrophenoxy)pentane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 346.116486302 u |
| Formula | C17H18N2O6 |
| InChI | InChI=1S/C17H18N2O6/c20-18(21)14-6-4-8-16(12-14)24-10-2-1-3-11-25-17-9-5-7-15(13-17)19(22)23/h4-9,12-13H,1-3,10-11H2 |
| InChIKey | WCJSSULXVRRUJR-UHFFFAOYSA-N |
| SMILES | N(=O)(=O)C1=CC=CC(OCCCCCOC2=CC=CC(=C2)N(=O)=O)=C1 |