| SpectraBase Compound ID | yzVVD8YKs6 |
|---|---|
| InChI | InChI=1S/C8H3N3O2/c9-4-6-1-2-8(11(12)13)3-7(6)5-10/h1-3H |
| InChIKey | NTZMSBAAHBICLE-UHFFFAOYSA-N |
| Mol Weight | 173.13 g/mol |
| Molecular Formula | C8H3N3O2 |
| Exact Mass | 173.022526 g/mol |
13C Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | DrHSEbmMsQm |
|---|---|
| Name | 4-Nitrophthalonitrile |
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Catalog Number | 330590 |
| CAS Registry Number | 31643-49-9 |
| Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H3N3O2 |
| InChI | InChI=1S/C8H3N3O2/c9-4-6-1-2-8(11(12)13)3-7(6)5-10/h1-3H |
| InChIKey | NTZMSBAAHBICLE-UHFFFAOYSA-N |
| Observed nucleus | 13C |
| Purity | 99% |
| Solvent | CDCl3 & DMSO-d6 |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Wiley ID | SIAL_13CNMR_006652 |