| SpectraBase Compound ID | 3d1Ir8TU7EC |
|---|---|
| InChI | InChI=1S/C9H14F3NO3/c1-2-3-4-5-16-7(14)6-13-8(15)9(10,11)12/h2-6H2,1H3,(H,13,15) |
| InChIKey | DRPXDUNICVCCGC-UHFFFAOYSA-N |
| Mol Weight | 241.21 g/mol |
| Molecular Formula | C9H14F3NO3 |
| Exact Mass | 241.092578 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GLf91d8zefD |
|---|---|
| Name | Glycine, N-trifluoroacetyl-, pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 241.092577801 u |
| Formula | C9H14F3NO3 |
| InChI | InChI=1S/C9H14F3NO3/c1-2-3-4-5-16-7(14)6-13-8(15)9(10,11)12/h2-6H2,1H3,(H,13,15) |
| InChIKey | DRPXDUNICVCCGC-UHFFFAOYSA-N |
| Molecular Weight | 241.210 g/mol |
| SMILES | CCCCCOC(CNC(C(F)(F)F)=O)=O |