![N-{[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl}phenylalanine](/api/spectrum/6os9T0YsOYl/structure.png?h=300&w=458 "N-{[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl}phenylalanine")
| SpectraBase Compound ID | 9j7Vfyhu8Ga |
|---|---|
| InChI | InChI=1S/C16H13ClF3NO4S/c17-13-7-6-11(9-12(13)16(18,19)20)26(24,25)21-14(15(22)23)8-10-4-2-1-3-5-10/h1-7,9,14,21H,8H2,(H,22,23) |
| InChIKey | FHMLDKPFAYXUSA-UHFFFAOYSA-N |
| Mol Weight | 407.79 g/mol |
| Molecular Formula | C16H13ClF3NO4S |
| Exact Mass | 407.020591 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 6os9T0YsOYl |
|---|---|
| Name | N-{[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl}phenylalanine |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 407.020591262 u |
| Formula | C16H13ClF3NO4S |
| InChI | InChI=1S/C16H13ClF3NO4S/c17-13-7-6-11(9-12(13)16(18,19)20)26(24,25)21-14(15(22)23)8-10-4-2-1-3-5-10/h1-7,9,14,21H,8H2,(H,22,23) |
| InChIKey | FHMLDKPFAYXUSA-UHFFFAOYSA-N |
| Molecular Weight | 407.791 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_2618 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12279717 |