| SpectraBase Compound ID | AbkFh3ardgC |
|---|---|
| InChI | InChI=1S/C23H26N4O3/c28-21(25-16-18-10-4-5-13-24-18)19-11-6-14-26(19)23(30)20-12-7-15-27(20)22(29)17-8-2-1-3-9-17/h1-5,8-10,13,19-20H,6-7,11-12,14-16H2,(H,25,28)/t19-,20-/m0/s1 |
| InChIKey | PIXXTDBPZPLLHE-PMACEKPBSA-N |
| Mol Weight | 406.49 g/mol |
| Molecular Formula | C23H26N4O3 |
| Exact Mass | 406.200491 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | IzMe7YHxEHD |
|---|---|
| Name | (S)-1-(Benzoyl-L-prolyl)-N-(pyridin-2-ylmethyl)pyrrolidine-2-carboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 406.200490710 u |
| Formula | C23H26N4O3 |
| InChI | InChI=1S/C23H26N4O3/c28-21(25-16-18-10-4-5-13-24-18)19-11-6-14-26(19)23(30)20-12-7-15-27(20)22(29)17-8-2-1-3-9-17/h1-5,8-10,13,19-20H,6-7,11-12,14-16H2,(H,25,28)/t19-,20-/m0/s1 |
| InChIKey | PIXXTDBPZPLLHE-PMACEKPBSA-N |
| Molecular Weight | 406.486 g/mol |
| SMILES | [C@]1(N(CCC1)C([C@]1(N(CCC1)C(C1=CC=CC=C1)=O)[H])=O)(C(=O)NCC1=CC=CC=N1)[H] |