| SpectraBase Compound ID | 4GeUFTdjy9x |
|---|---|
| InChI | InChI=1S/C17H23NO6/c1-2-3-9-13(10-14(19)20)15(16(21)22)18-17(23)24-11-12-7-5-4-6-8-12/h4-8,13,15H,2-3,9-11H2,1H3,(H,18,23)(H,19,20)(H,21,22)/t13-,15-/m0/s1 |
| InChIKey | ZXXKDLSIVWHNFS-ZFWWWQNUSA-N |
| Mol Weight | 337.37 g/mol |
| Molecular Formula | C17H23NO6 |
| Exact Mass | 337.152537 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Fm0MJ9BuM9B |
|---|---|
| Name | (2S,3S)-2-(Benzyloxycarbonyl)-3-butylglutamic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 337.152537459 u |
| Formula | C17H23NO6 |
| InChI | InChI=1S/C17H23NO6/c1-2-3-9-13(10-14(19)20)15(16(21)22)18-17(23)24-11-12-7-5-4-6-8-12/h4-8,13,15H,2-3,9-11H2,1H3,(H,18,23)(H,19,20)(H,21,22)/t13-,15-/m0/s1 |
| InChIKey | ZXXKDLSIVWHNFS-ZFWWWQNUSA-N |
| Molecular Weight | 337.372 g/mol |
| SMILES | C(N[C@](C(=O)O)([C@](CC(=O)O)(CCCC)[H])[H])(=O)OCC1=CC=CC=C1 |