| SpectraBase Compound ID | FEKowyHaSA0 |
|---|---|
| InChI | InChI=1S/C7H6N2O5/c1-4-2-5(8(11)12)3-6(7(4)10)9(13)14/h2-3,10H,1H3 |
| InChIKey | ZXVONLUNISGICL-UHFFFAOYSA-N |
| Mol Weight | 198.13 g/mol |
| Molecular Formula | C7H6N2O5 |
| Exact Mass | 198.027671 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | L4i3RYGHxAn |
|---|---|
| Name | 4,6-Dinitro-ortho-cresol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H6N2O5 |
| InChI | InChI=1S/C7H6N2O5/c1-4-2-5(8(11)12)3-6(7(4)10)9(13)14/h2-3,10H,1H3 |
| InChIKey | ZXVONLUNISGICL-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 198.134 g/mol |
| SMILES | Oc1c(cc([N+]([O-])=O)cc1C)[N+]([O-])=O |
| SPLASH | splash10-0f6t-9600000000-64c18bc847567dd0a61e |
| Source of Spectrum | SRH-2022-976-0 |
| Wiley ID | 1823449 |