| SpectraBase Compound ID | A6F6zKNGoR |
|---|---|
| InChI | InChI=1S/C9H16FNO2/c1-6(10)5-7(11)8(12)13-9(2,3)4/h7H,1,5,11H2,2-4H3 |
| InChIKey | CIKIRIDCKNPYQV-UHFFFAOYSA-N |
| Mol Weight | 189.23 g/mol |
| Molecular Formula | C9H16FNO2 |
| Exact Mass | 189.116507 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GBfBjbeMd0i |
|---|---|
| Name | ter-Butyl 2-amino-4-fluoropent-4-enoate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 189.116506920 u |
| Formula | C9H16FNO2 |
| InChI | InChI=1S/C9H16FNO2/c1-6(10)5-7(11)8(12)13-9(2,3)4/h7H,1,5,11H2,2-4H3 |
| InChIKey | CIKIRIDCKNPYQV-UHFFFAOYSA-N |
| Molecular Weight | 189.230 g/mol |
| SMILES | C(OC(C)(C)C)(C(CC(=C)F)N)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.932902 |