| SpectraBase Compound ID | JSv2dh4uYrC |
|---|---|
| InChI | InChI=1S/C14H17F2NO3/c1-3-4-8-20-12(18)9-17(2)14(19)13-10(15)6-5-7-11(13)16/h5-7H,3-4,8-9H2,1-2H3 |
| InChIKey | KKKLIMVPEHCITK-UHFFFAOYSA-N |
| Mol Weight | 285.29 g/mol |
| Molecular Formula | C14H17F2NO3 |
| Exact Mass | 285.11765 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3rXaJGOcvw8 |
|---|---|
| Name | Sarcosine, N-(2,6-difluorobenzoyl)-, butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 285.117649734 u |
| Formula | C14H17F2NO3 |
| InChI | InChI=1S/C14H17F2NO3/c1-3-4-8-20-12(18)9-17(2)14(19)13-10(15)6-5-7-11(13)16/h5-7H,3-4,8-9H2,1-2H3 |
| InChIKey | KKKLIMVPEHCITK-UHFFFAOYSA-N |
| Molecular Weight | 285.291 g/mol |
| SMILES | C1(=CC=CC(=C1C(N(CC(OCCCC)=O)C)=O)F)F |