| SpectraBase Compound ID | 9Lg9sfFTJYk |
|---|---|
| InChI | InChI=1S/C7H3N3O4/c8-4-5-1-6(9(11)12)3-7(2-5)10(13)14/h1-3H |
| InChIKey | SSDNULNTQAUNFQ-UHFFFAOYSA-N |
| Mol Weight | 193.12 g/mol |
| Molecular Formula | C7H3N3O4 |
| Exact Mass | 193.012356 g/mol |
13C Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | LtUv0yN2mBd |
|---|---|
| Name | 3,5-Dinitrobenzonitrile |
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Catalog Number | D195006 |
| CAS Registry Number | 4110-35-4 |
| Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H3N3O4 |
| InChI | InChI=1S/C7H3N3O4/c8-4-5-1-6(9(11)12)3-7(2-5)10(13)14/h1-3H |
| InChIKey | SSDNULNTQAUNFQ-UHFFFAOYSA-N |
| Observed nucleus | 13C |
| Purity | 97% |
| Solvent | CDCl3 & DMSO-d6 |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Wiley ID | SIAL_13CNMR_011504 |