![6-Aminohexanoic acid, N-benzyloxycarbonyl-2-[(9-fluorenyl)methoxycarbonyl)]](/api/spectrum/JnlhiPeXL08/structure.png?h=300&w=458 "6-Aminohexanoic acid, N-benzyloxycarbonyl-2-[(9-fluorenyl)methoxycarbonyl)]")
| SpectraBase Compound ID | 4cwRTNOw8EN |
|---|---|
| InChI | InChI=1S/C29H30N2O6/c32-27(33)26(16-8-9-17-30-28(34)36-18-20-10-2-1-3-11-20)31-29(35)37-19-25-23-14-6-4-12-21(23)22-13-5-7-15-24(22)25/h1-7,10-15,25-26H,8-9,16-19H2,(H,30,34)(H,31,35)(H,32,33) |
| InChIKey | KRULQRVJXQQPQH-UHFFFAOYSA-N |
| Mol Weight | 502.57 g/mol |
| Molecular Formula | C29H30N2O6 |
| Exact Mass | 502.210387 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JnlhiPeXL08 |
|---|---|
| Name | 6-Aminohexanoic acid, N-benzyloxycarbonyl-2-[(9-fluorenyl)methoxycarbonyl)] |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 502.210386688 u |
| Formula | C29H30N2O6 |
| InChI | InChI=1S/C29H30N2O6/c32-27(33)26(16-8-9-17-30-28(34)36-18-20-10-2-1-3-11-20)31-29(35)37-19-25-23-14-6-4-12-21(23)22-13-5-7-15-24(22)25/h1-7,10-15,25-26H,8-9,16-19H2,(H,30,34)(H,31,35)(H,32,33) |
| InChIKey | KRULQRVJXQQPQH-UHFFFAOYSA-N |
| Molecular Weight | 502.567 g/mol |
| SMILES | C12=C(C=CC=C2)C2=CC=CC=C2C1COC(=O)NC(CCCCNC(=O)OCC1=CC=CC=C1)C(O)=O |