| SpectraBase Compound ID | Fjc8ZC4gWN5 |
|---|---|
| InChI | InChI=1S/C18H31NO4S/c1-4-6-7-8-9-10-11-14-22-17(20)16(12-15-24-3)19-18(21)23-13-5-2/h2,16H,4,6-15H2,1,3H3,(H,19,21) |
| InChIKey | DCKZYEHULVPSPD-UHFFFAOYSA-N |
| Mol Weight | 357.51 g/mol |
| Molecular Formula | C18H31NO4S |
| Exact Mass | 357.19738 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4L2ie52qpqG |
|---|---|
| Name | L-Methionine, N-propargyloxycarbonyl-, nonyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 357.197379652 u |
| Formula | C18H31NO4S |
| InChI | InChI=1S/C18H31NO4S/c1-4-6-7-8-9-10-11-14-22-17(20)16(12-15-24-3)19-18(21)23-13-5-2/h2,16H,4,6-15H2,1,3H3,(H,19,21) |
| InChIKey | DCKZYEHULVPSPD-UHFFFAOYSA-N |
| Molecular Weight | 357.509 g/mol |
| SMILES | C#CCOC(NC(C(OCCCCCCCCC)=O)CCSC)=O |