| SpectraBase Compound ID | HWfo3XBixYg |
|---|---|
| InChI | InChI=1S/C18H19NO4S/c20-17(21)16(13-24-12-15-9-5-2-6-10-15)19-18(22)23-11-14-7-3-1-4-8-14/h1-10,16H,11-13H2,(H,19,22)(H,20,21) |
| InChIKey | ATPNWHGYKFXQNF-UHFFFAOYSA-N |
| Mol Weight | 345.41 g/mol |
| Molecular Formula | C18H19NO4S |
| Exact Mass | 345.103479 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BfrzRTyXwAK |
|---|---|
| Name | 3-(benzylthio)-N-carboxy-L-alanine, N-benzyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H19NO4S |
| InChI | InChI=1S/C18H19NO4S/c20-17(21)16(13-24-12-15-9-5-2-6-10-15)19-18(22)23-11-14-7-3-1-4-8-14/h1-10,16H,11-13H2,(H,19,22)(H,20,21) |
| InChIKey | ATPNWHGYKFXQNF-UHFFFAOYSA-N |
| Instrument Name | Varian A-60D |
| Sadtler NMR Number | 18110M |
| Solvent | CDCl3 |