| SpectraBase Compound ID | DNYFYfbCtbp |
|---|---|
| InChI | InChI=1S/C14H9N3O4/c15-7-4-5-8(16)12-11(7)13(18)6-2-1-3-9(17(20)21)10(6)14(12)19/h1-5H,15-16H2 |
| InChIKey | SDICTISQCKLMEB-UHFFFAOYSA-N |
| Mol Weight | 283.24 g/mol |
| Molecular Formula | C14H9N3O4 |
| Exact Mass | 283.059306 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IM3dwdWSXCG |
|---|---|
| Name | Sodyesperse violet B |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 283.059305778 u |
| Formula | C14H9N3O4 |
| InChI | InChI=1S/C14H9N3O4/c15-7-4-5-8(16)12-11(7)13(18)6-2-1-3-9(17(20)21)10(6)14(12)19/h1-5H,15-16H2 |
| InChIKey | SDICTISQCKLMEB-UHFFFAOYSA-N |
| Molecular Weight | 283.243 g/mol |
| Nominal Mass | 283 u |
| SMILES | NC=1C=2C(C=3C=CC=C(C3C(C2C(=CC1)N)=O)N(=O)=O)=O |