| SpectraBase Compound ID | D19XoIFjYkc |
|---|---|
| InChI | InChI=1S/C8H7NO4/c1-13-8(10)6-3-2-4-7(5-6)9(11)12/h2-5H,1H3 |
| InChIKey | AXLYJLKKPUICKV-UHFFFAOYSA-N |
| Mol Weight | 181.15 g/mol |
| Molecular Formula | C8H7NO4 |
| Exact Mass | 181.037508 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 4ohTDzknZuS |
|---|---|
| Name | 3-Nitrobenzoic acid methyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H7NO4 |
| InChI | InChI=1S/C8H7NO4/c1-13-8(10)6-3-2-4-7(5-6)9(11)12/h2-5H,1H3 |
| InChIKey | AXLYJLKKPUICKV-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 181.147 g/mol |
| SMILES | COC(=O)c1cccc(c1)[N+]([O-])=O |
| SPLASH | splash10-0udi-4900000000-65347b94114b1ff6f602 |
| Source of Spectrum | SRH-2022-4213-0 |
| Wiley ID | 1826374 |