| SpectraBase Compound ID | GrwK61BxlK4 |
|---|---|
| InChI | InChI=1S/C8H6ClNO4/c1-14-8(11)6-3-2-5(10(12)13)4-7(6)9/h2-4H,1H3 |
| InChIKey | PICNSXCJRMYANX-UHFFFAOYSA-N |
| Mol Weight | 215.59 g/mol |
| Molecular Formula | C8H6ClNO4 |
| Exact Mass | 214.998535 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 309ye9J5j91 |
|---|---|
| Name | 2-Chloro-4-nitrobenzoic acid methyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H6ClNO4 |
| InChI | InChI=1S/C8H6ClNO4/c1-14-8(11)6-3-2-5(10(12)13)4-7(6)9/h2-4H,1H3 |
| InChIKey | PICNSXCJRMYANX-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 215.592 g/mol |
| SMILES | COC(=O)c1ccc(cc1Cl)[N+]([O-])=O |
| SPLASH | splash10-001r-3910000000-ae033fe5196e95f48f36 |
| Source of Spectrum | SRH-2022-2649-0 |
| Wiley ID | 1825004 |