| SpectraBase Compound ID | 6ht76vQwsdP |
|---|---|
| InChI | InChI=1S/C14H14F5NO3/c1-3-4-5-23-7(21)6-20(2)14(22)8-9(15)11(17)13(19)12(18)10(8)16/h3-6H2,1-2H3 |
| InChIKey | XAPWDOHNXMABAC-UHFFFAOYSA-N |
| Mol Weight | 339.26 g/mol |
| Molecular Formula | C14H14F5NO3 |
| Exact Mass | 339.089384 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KK2COADSpKn |
|---|---|
| Name | Sarcosine, N-pentafluorobenzoyl-, butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 339.089384127 u |
| Formula | C14H14F5NO3 |
| InChI | InChI=1S/C14H14F5NO3/c1-3-4-5-23-7(21)6-20(2)14(22)8-9(15)11(17)13(19)12(18)10(8)16/h3-6H2,1-2H3 |
| InChIKey | XAPWDOHNXMABAC-UHFFFAOYSA-N |
| Molecular Weight | 339.262 g/mol |
| SMILES | C(CN(C(=O)C1=C(C(=C(C(=C1F)F)F)F)F)C)(OCCCC)=O |