| SpectraBase Compound ID | 4XbzFc3M2jg |
|---|---|
| InChI | InChI=1S/C18H20N2O4/c1-9-7-15(17(19(21)22)13(5)11(9)3)16-8-10(2)12(4)14(6)18(16)20(23)24/h7-8H,1-6H3 |
| InChIKey | WSCHXRRLUWMYCQ-UHFFFAOYSA-N |
| Mol Weight | 328.37 g/mol |
| Molecular Formula | C18H20N2O4 |
| Exact Mass | 328.142307 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | DsKCCOIPkC6 |
|---|---|
| Name | 2,2'-Dinitro-3,3',4,4',5,5'-hexamethylbiphenyl |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 328.142307128 u |
| Formula | C18H20N2O4 |
| InChI | InChI=1S/C18H20N2O4/c1-9-7-15(17(19(21)22)13(5)11(9)3)16-8-10(2)12(4)14(6)18(16)20(23)24/h7-8H,1-6H3 |
| InChIKey | WSCHXRRLUWMYCQ-UHFFFAOYSA-N |
| SMILES | N(=O)(=O)C=1C(C2=CC(=C(C(=C2N(=O)=O)C)C)C)=CC(=C(C1C)C)C |