| SpectraBase Compound ID | ACVbspejnSf |
|---|---|
| InChI | InChI=1S/C17H25NO4S/c1-13(2)22-17(20)18(12-14-8-6-5-7-9-14)15(10-11-23-4)16(19)21-3/h5-9,13,15H,10-12H2,1-4H3 |
| InChIKey | SAOPWTZOAZWGTK-UHFFFAOYSA-N |
| Mol Weight | 339.45 g/mol |
| Molecular Formula | C17H25NO4S |
| Exact Mass | 339.150429 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BOuoUNioU0a |
|---|---|
| Name | N-Benzyl-D-methionine, N-(isopropyloxycarbonyl)-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 339.150429459 u |
| Formula | C17H25NO4S |
| InChI | InChI=1S/C17H25NO4S/c1-13(2)22-17(20)18(12-14-8-6-5-7-9-14)15(10-11-23-4)16(19)21-3/h5-9,13,15H,10-12H2,1-4H3 |
| InChIKey | SAOPWTZOAZWGTK-UHFFFAOYSA-N |
| Molecular Weight | 339.450 g/mol |
| SMILES | C1(=CC=CC=C1)CN(C(CCSC)C(=O)OC)C(OC(C)C)=O |