| SpectraBase Compound ID | 6oE32pOrg3v |
|---|---|
| InChI | InChI=1S/C9H11NO4S/c1-10(7-9(11)12)15(13,14)8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,11,12) |
| InChIKey | XQGWHYCLQRSQSQ-UHFFFAOYSA-N |
| Mol Weight | 229.25 g/mol |
| Molecular Formula | C9H11NO4S |
| Exact Mass | 229.040879 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L8bhDBNfL9B |
|---|---|
| Name | Glycine, N-methyl-N-(phenylsulfonyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 229.040879008 u |
| Formula | C9H11NO4S |
| InChI | InChI=1S/C9H11NO4S/c1-10(7-9(11)12)15(13,14)8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,11,12) |
| InChIKey | XQGWHYCLQRSQSQ-UHFFFAOYSA-N |
| Molecular Weight | 229.250 g/mol |
| SMILES | OC(CN(S(C1=CC=CC=C1)(=O)=O)C)=O |