| SpectraBase Compound ID | K33mC6pRjUT |
|---|---|
| InChI | InChI=1S/C15H10FNO6/c1-22-14(18)10-4-2-3-5-11(10)15(19)23-13-7-6-9(16)8-12(13)17(20)21/h2-8H,1H3 |
| InChIKey | XERUIMJJQNLLTI-UHFFFAOYSA-N |
| Mol Weight | 319.24 g/mol |
| Molecular Formula | C15H10FNO6 |
| Exact Mass | 319.049215 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | CKlPMU4nU3p |
|---|---|
| Name | Phthalic acid, 4-fluoro-2-nitrophenyl methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 319.049215203 u |
| Formula | C15H10FNO6 |
| InChI | InChI=1S/C15H10FNO6/c1-22-14(18)10-4-2-3-5-11(10)15(19)23-13-7-6-9(16)8-12(13)17(20)21/h2-8H,1H3 |
| InChIKey | XERUIMJJQNLLTI-UHFFFAOYSA-N |
| Molecular Weight | 319.244 g/mol |
| SMILES | C1=CC=CC(=C1C(OC)=O)C(OC1=C(C=C(C=C1)F)N(=O)=O)=O |