![4-({[3-(trifluoromethyl)phenyl]sulfonyl}amino)butanoic acid](/api/spectrum/3O0NuuurD9n/structure.png?h=300&w=458 "4-({[3-(trifluoromethyl)phenyl]sulfonyl}amino)butanoic acid")
| SpectraBase Compound ID | 2qvUERcgSfO |
|---|---|
| InChI | InChI=1S/C11H12F3NO4S/c12-11(13,14)8-3-1-4-9(7-8)20(18,19)15-6-2-5-10(16)17/h1,3-4,7,15H,2,5-6H2,(H,16,17) |
| InChIKey | YMRXWPCWJDWPCO-UHFFFAOYSA-N |
| Mol Weight | 311.28 g/mol |
| Molecular Formula | C11H12F3NO4S |
| Exact Mass | 311.043914 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 3O0NuuurD9n |
|---|---|
| Name | 4-({[3-(trifluoromethyl)phenyl]sulfonyl}amino)butanoic acid |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 311.043913529 u |
| Formula | C11H12F3NO4S |
| InChI | InChI=1S/C11H12F3NO4S/c12-11(13,14)8-3-1-4-9(7-8)20(18,19)15-6-2-5-10(16)17/h1,3-4,7,15H,2,5-6H2,(H,16,17) |
| InChIKey | YMRXWPCWJDWPCO-UHFFFAOYSA-N |
| Molecular Weight | 311.275 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_2627 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12279727 |