![2-[4-(Difluoromethoxy)anilino]benzoic acid, N-methyl-, methyl ester](/api/spectrum/5mUbRSuNbRG/structure.png?h=300&w=458 "2-[4-(Difluoromethoxy)anilino]benzoic acid, N-methyl-, methyl ester")
| SpectraBase Compound ID | DX1SaqVFYRC |
|---|---|
| InChI | InChI=1S/C16H15F2NO3/c1-19(11-7-9-12(10-8-11)22-16(17)18)14-6-4-3-5-13(14)15(20)21-2/h3-10,16H,1-2H3 |
| InChIKey | IDSJJNZYLBFGNO-UHFFFAOYSA-N |
| Mol Weight | 307.3 g/mol |
| Molecular Formula | C16H15F2NO3 |
| Exact Mass | 307.102 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5mUbRSuNbRG |
|---|---|
| Name | 2-[4-(Difluoromethoxy)anilino]benzoic acid, N-methyl-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 307.101999670 u |
| Formula | C16H15F2NO3 |
| InChI | InChI=1S/C16H15F2NO3/c1-19(11-7-9-12(10-8-11)22-16(17)18)14-6-4-3-5-13(14)15(20)21-2/h3-10,16H,1-2H3 |
| InChIKey | IDSJJNZYLBFGNO-UHFFFAOYSA-N |
| Molecular Weight | 307.297 g/mol |
| SMILES | C(F)(F)OC1=CC=C(C=C1)N(C1=C(C=CC=C1)C(=O)OC)C |