| SpectraBase Compound ID | Cdgly26uddb |
|---|---|
| InChI | InChI=1S/C25H27NO2/c27-24(28)19-11-4-12-20-26-25(21-13-5-1-6-14-21,22-15-7-2-8-16-22)23-17-9-3-10-18-23/h1-3,5-10,13-18,26H,4,11-12,19-20H2,(H,27,28) |
| InChIKey | RIHLCYPQNGWANI-UHFFFAOYSA-N |
| Mol Weight | 373.5 g/mol |
| Molecular Formula | C25H27NO2 |
| Exact Mass | 373.204179 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4lpudkcHEdW |
|---|---|
| Name | 6-(Trityl-amino)hexanoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 373.204179111 u |
| Formula | C25H27NO2 |
| InChI | InChI=1S/C25H27NO2/c27-24(28)19-11-4-12-20-26-25(21-13-5-1-6-14-21,22-15-7-2-8-16-22)23-17-9-3-10-18-23/h1-3,5-10,13-18,26H,4,11-12,19-20H2,(H,27,28) |
| InChIKey | RIHLCYPQNGWANI-UHFFFAOYSA-N |
| Molecular Weight | 373.496 g/mol |
| SMILES | C1=CC=CC=C1C(C1=CC=CC=C1)(C1=CC=CC=C1)NCCCCCC(O)=O |