![3-[3-[5-[[1-(tert-Butoxycarbonyl)-2(S)-azetidinyl]methoxy]-3-pyridyl]phenyl]propanamine](/api/spectrum/9hFGQe81pmG/structure.png?h=300&w=458 "3-[3-[5-[[1-(tert-Butoxycarbonyl)-2(S)-azetidinyl]methoxy]-3-pyridyl]phenyl]propanamine")
| SpectraBase Compound ID | FAjuzUonaHY |
|---|---|
| InChI | InChI=1S/C23H31N3O3/c1-23(2,3)29-22(27)26-11-9-20(26)16-28-21-13-19(14-25-15-21)18-8-4-6-17(12-18)7-5-10-24/h4,6,8,12-15,20H,5,7,9-11,16,24H2,1-3H3/t20-/m0/s1 |
| InChIKey | FRDKHTKZCOITEX-FQEVSTJZSA-N |
| Mol Weight | 397.52 g/mol |
| Molecular Formula | C23H31N3O3 |
| Exact Mass | 397.236542 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9hFGQe81pmG |
|---|---|
| Name | 3-[3-[5-[[1-(tert-Butoxycarbonyl)-2(S)-azetidinyl]methoxy]-3-pyridyl]phenyl]propanamine |
| Appearance | Colorless film |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H31N3O3 |
| InChI | InChI=1S/C23H31N3O3/c1-23(2,3)29-22(27)26-11-9-20(26)16-28-21-13-19(14-25-15-21)18-8-4-6-17(12-18)7-5-10-24/h4,6,8,12-15,20H,5,7,9-11,16,24H2,1-3H3/t20-/m0/s1 |
| InChIKey | FRDKHTKZCOITEX-FQEVSTJZSA-N |
| Ionization Type | EI |
| Molecular Weight | 397.519 g/mol |
| SMILES | NCCCc1cc(-c2cncc(OC[C@@]3(CCN3C(OC(C)(C)C)=O)[H])c2)ccc1 |
| SPLASH | splash10-0a4i-9120000000-c93aac76fa7d890d7645 |
| Source of Spectrum | US20100152450A1 |
| Wiley ID | 1842409 |