SpectraBase Compound ID | yzVVD8YKs6 |
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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 |
SpectraBase Spectrum ID | CQYrjqWi4S9 |
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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 | 1H |
Purity | 99% |
Solvent | CDCl3 & DMSO-d6 |
Source of Spectrum | Sigma-Aldrich Co. LLC. |
Wiley ID | SIAL_1HNMR_006592 |