| SpectraBase Compound ID | 7bu5sjHsA21 |
|---|---|
| InChI | InChI=1S/C8H5NO6/c10-7(11)4-2-1-3-5(9(14)15)6(4)8(12)13/h1-3H,(H,10,11)(H,12,13) |
| InChIKey | KFIRODWJCYBBHY-UHFFFAOYSA-N |
| Mol Weight | 211.13 g/mol |
| Molecular Formula | C8H5NO6 |
| Exact Mass | 211.011687 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4zjG2rNIY |
|---|---|
| Name | 3-Nitrophthalic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H5NO6 |
| InChI | InChI=1S/C8H5NO6/c10-7(11)4-2-1-3-5(9(14)15)6(4)8(12)13/h1-3H,(H,10,11)(H,12,13) |
| InChIKey | KFIRODWJCYBBHY-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 211.129 g/mol |
| SMILES | OC(c1c(C(O)=O)c(ccc1)[N+]([O-])=O)=O |
| SPLASH | splash10-016s-9800000000-e585cb2522d0dfa6f65c |
| Source of Spectrum | SRH-2022-6265-0 |
| Wiley ID | 1828107 |