| SpectraBase Compound ID | 32DS3Fumwtb |
|---|---|
| InChI | InChI=1S/C6H6N2O4/c1-7-3-4(8(11)12)2-5(7)6(9)10/h2-3H,1H3,(H,9,10) |
| InChIKey | GEGNYFQOFWUIFG-UHFFFAOYSA-N |
| Mol Weight | 170.12 g/mol |
| Molecular Formula | C6H6N2O4 |
| Exact Mass | 170.032757 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4aNoGVXWoPb |
|---|---|
| Name | GEGNYFQOFWUIFG-UHFFFAOYSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C6H6N2O4 |
| InChI | InChI=1S/C6H6N2O4/c1-7-3-4(8(11)12)2-5(7)6(9)10/h2-3H,1H3,(H,9,10) |
| InChIKey | GEGNYFQOFWUIFG-UHFFFAOYSA-N |
| Literature Reference Author | ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ |
| Literature Reference Citation | UNI_MAINZ,INTERNAL_DB(2006) |
| Molecular Weight | 170.125 g/mol |
| Source File Reference | MHKO21617 |