| SpectraBase Compound ID | 8zQPyEqUTBK |
|---|---|
| InChI | InChI=1S/C24H27NO4/c26-23(27)22(14-16-8-2-1-3-9-16)25-24(28)29-15-21-19-12-6-4-10-17(19)18-11-5-7-13-20(18)21/h4-7,10-13,16,21-22H,1-3,8-9,14-15H2,(H,25,28)(H,26,27)/t22-/m1/s1 |
| InChIKey | HIJAUEZBPWTKIV-JOCHJYFZSA-N |
| Mol Weight | 393.48 g/mol |
| Molecular Formula | C24H27NO4 |
| Exact Mass | 393.194008 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DUOi49pi1F1 |
|---|---|
| Name | N-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-3-cyclohexyl-D-alanine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 393.194008349 u |
| Formula | C24H27NO4 |
| InChI | InChI=1S/C24H27NO4/c26-23(27)22(14-16-8-2-1-3-9-16)25-24(28)29-15-21-19-12-6-4-10-17(19)18-11-5-7-13-20(18)21/h4-7,10-13,16,21-22H,1-3,8-9,14-15H2,(H,25,28)(H,26,27)/t22-/m1/s1 |
| InChIKey | HIJAUEZBPWTKIV-JOCHJYFZSA-N |
| Molecular Weight | 393.483 g/mol |
| SMILES | N([C@@](C(O)=O)(CC1CCCCC1)[H])C(OCC1C=2C=CC=CC2C=2C=CC=CC12)=O |