| SpectraBase Compound ID | AlgD1KIr2m |
|---|---|
| InChI | InChI=1S/C8H7NO5/c1-4-2-5(9(13)14)3-6(7(4)10)8(11)12/h2-3,10H,1H3,(H,11,12) |
| InChIKey | JNZXWLAEKYYPHA-UHFFFAOYSA-N |
| Mol Weight | 197.15 g/mol |
| Molecular Formula | C8H7NO5 |
| Exact Mass | 197.032422 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 46PioE0W1Y |
|---|---|
| Name | 5-nitro-3-cresotinic acid |
| Appearance | Brown solid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H7NO5 |
| InChI | InChI=1S/C8H7NO5/c1-4-2-5(9(13)14)3-6(7(4)10)8(11)12/h2-3,10H,1H3,(H,11,12) |
| InChIKey | JNZXWLAEKYYPHA-UHFFFAOYSA-N |
| Ionization Type | EI |
| Molecular Weight | 197.146 g/mol |
| SMILES | Oc1c(C(=O)O)cc(cc1C)[N+](=O)[O-] |
| SPLASH | splash10-00di-9000000000-160eaf7ef39d08853738 |
| Source of Spectrum | CN1850334B |
| Wiley ID | 1844923 |