| SpectraBase Compound ID | I2sInt0wvrk |
|---|---|
| InChI | InChI=1S/C12H14FNO2/c1-3-16-12(15)8-9(2)14-11-6-4-10(13)5-7-11/h4-8,14H,3H2,1-2H3 |
| InChIKey | BUDOLSNUNUYBLF-UHFFFAOYSA-N |
| Mol Weight | 223.25 g/mol |
| Molecular Formula | C12H14FNO2 |
| Exact Mass | 223.100857 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8KxFAa47VLo |
|---|---|
| Name | Ethyl 3-(4-fluoroanilino)crotonate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 223.100856856 u |
| Formula | C12H14FNO2 |
| InChI | InChI=1S/C12H14FNO2/c1-3-16-12(15)8-9(2)14-11-6-4-10(13)5-7-11/h4-8,14H,3H2,1-2H3 |
| InChIKey | BUDOLSNUNUYBLF-UHFFFAOYSA-N |
| Molecular Weight | 223.247 g/mol |
| SMILES | N(C1=CC=C(C=C1)F)C(=CC(OCC)=O)C |