![3-[3-[5-[[1-(tert-Butoxycarbonyl)-2(S)-azetidinyl]methoxy]-3-pyridyl]phenyl]-1-propanol](/api/spectrum/G0DGJKaQOuu/structure.png?h=300&w=458 "3-[3-[5-[[1-(tert-Butoxycarbonyl)-2(S)-azetidinyl]methoxy]-3-pyridyl]phenyl]-1-propanol")
| SpectraBase Compound ID | EhvxarGqP4p |
|---|---|
| InChI | InChI=1S/C23H30N2O4/c1-23(2,3)29-22(27)25-10-9-20(25)16-28-21-13-19(14-24-15-21)18-8-4-6-17(12-18)7-5-11-26/h4,6,8,12-15,20,26H,5,7,9-11,16H2,1-3H3/t20-/m0/s1 |
| InChIKey | KZPJNJNSQYAREU-FQEVSTJZSA-N |
| Mol Weight | 398.5 g/mol |
| Molecular Formula | C23H30N2O4 |
| Exact Mass | 398.220557 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | G0DGJKaQOuu |
|---|---|
| Name | 3-[3-[5-[[1-(tert-Butoxycarbonyl)-2(S)-azetidinyl]methoxy]-3-pyridyl]phenyl]-1-propanol |
| Appearance | Glass |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H30N2O4 |
| InChI | InChI=1S/C23H30N2O4/c1-23(2,3)29-22(27)25-10-9-20(25)16-28-21-13-19(14-24-15-21)18-8-4-6-17(12-18)7-5-11-26/h4,6,8,12-15,20,26H,5,7,9-11,16H2,1-3H3/t20-/m0/s1 |
| InChIKey | KZPJNJNSQYAREU-FQEVSTJZSA-N |
| Ionization Type | EI |
| Molecular Weight | 398.503 g/mol |
| SMILES | OCCCc1cccc(-c2cc(OC[C@@]3(CCN3C(OC(C)(C)C)=O)[H])cnc2)c1 |
| SPLASH | splash10-0a4i-9120000000-64836fd26ddaccf196b9 |
| Source of Spectrum | US20100152450A1 |
| Wiley ID | 1842403 |