| SpectraBase Compound ID | As9OAfhX48G |
|---|---|
| InChI | InChI=1S/C25H28N4O2/c26-24(27)28-18-10-17-22(23(30)31)29-25(19-11-4-1-5-12-19,20-13-6-2-7-14-20)21-15-8-3-9-16-21/h1-9,11-16,22,29H,10,17-18H2,(H,30,31)(H4,26,27,28) |
| InChIKey | XOPFDFWTKCSBGX-UHFFFAOYSA-N |
| Mol Weight | 416.52 g/mol |
| Molecular Formula | C25H28N4O2 |
| Exact Mass | 416.221226 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | afRwbim5su |
|---|---|
| Name | N^2-Trityl-L-arginine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 416.221226156 u |
| Formula | C25H28N4O2 |
| InChI | InChI=1S/C25H28N4O2/c26-24(27)28-18-10-17-22(23(30)31)29-25(19-11-4-1-5-12-19,20-13-6-2-7-14-20)21-15-8-3-9-16-21/h1-9,11-16,22,29H,10,17-18H2,(H,30,31)(H4,26,27,28) |
| InChIKey | XOPFDFWTKCSBGX-UHFFFAOYSA-N |
| SMILES | N(C(C(O)=O)CCCNC(N)=N)C(C=1C=CC=CC1)(C=1C=CC=CC1)C=1C=CC=CC1 |