![11-[6-(Carboxyamino)hexanamido]undecanoic acid, benzyl ester, 1-hydrazide](/api/spectrum/9DHU5OTHUkd/structure.png?h=300&w=458 "11-[6-(Carboxyamino)hexanamido]undecanoic acid, benzyl ester, 1-hydrazide")
| SpectraBase Compound ID | C11FQvlwZeG |
|---|---|
| InChI | InChI=1S/C25H42N4O4/c26-29-24(31)18-11-5-3-1-2-4-6-13-19-27-23(30)17-12-8-14-20-28-25(32)33-21-22-15-9-7-10-16-22/h7,9-10,15-16H,1-6,8,11-14,17-21,26H2,(H,27,30)(H,28,32)(H,29,31) |
| InChIKey | OJJCEIMTZWXQOX-UHFFFAOYSA-N |
| Mol Weight | 462.6 g/mol |
| Molecular Formula | C25H42N4O4 |
| Exact Mass | 462.320606 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9DHU5OTHUkd |
|---|---|
| Name | 11-[6-(Carboxyamino)hexanamido]undecanoic acid, benzyl ester, 1-hydrazide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 462.320605844 u |
| Formula | C25H42N4O4 |
| InChI | InChI=1S/C25H42N4O4/c26-29-24(31)18-11-5-3-1-2-4-6-13-19-27-23(30)17-12-8-14-20-28-25(32)33-21-22-15-9-7-10-16-22/h7,9-10,15-16H,1-6,8,11-14,17-21,26H2,(H,27,30)(H,28,32)(H,29,31) |
| InChIKey | OJJCEIMTZWXQOX-UHFFFAOYSA-N |
| Molecular Weight | 462.635 g/mol |
| SMILES | N(C(=O)OCC1=CC=CC=C1)CCCCCC(=O)NCCCCCCCCCCC(=O)NN |