| SpectraBase Compound ID | FF7brgPrG9N |
|---|---|
| InChI | InChI=1S/C13H8ClNO4/c14-9-4-3-5-10(8-9)19-13(16)11-6-1-2-7-12(11)15(17)18/h1-8H |
| InChIKey | JIORWGHXIJPGIP-UHFFFAOYSA-N |
| Mol Weight | 277.66 g/mol |
| Molecular Formula | C13H8ClNO4 |
| Exact Mass | 277.014185 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E4m2U09fZtN |
|---|---|
| Name | 2-Nitrobenzoic acid (3-chlorophenyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 277.014185438 u |
| Formula | C13H8ClNO4 |
| InChI | InChI=1S/C13H8ClNO4/c14-9-4-3-5-10(8-9)19-13(16)11-6-1-2-7-12(11)15(17)18/h1-8H |
| InChIKey | JIORWGHXIJPGIP-UHFFFAOYSA-N |
| SMILES | C=1(N(=O)=O)C(C(OC=2C=C(Cl)C=CC2)=O)=CC=CC1 |