1-{(1S,2S,3S,4R,5R)-3-Hydroxy-2-[(4-methoxybenzyl)amino]-6,8-dioxabicyclo[3.2.1]oct-4-yl}-4-piperidinecarboxamide
11228
Reference
1-{(1S,2S,3S,4R,5R)-3-Hydroxy-2-[(4-methoxybenzyl)amino]-6,8-dioxabicyclo[3.2.1]oct-4-yl}-4-piperidinecarboxamide Structure
Systematic / IUPAC Name: 1-[(1S,2S,3S,4R,5R)-3-Hydroxy-2-[(4-methoxyphenyl)methylamino]-6,8-dioxabicyclo[3.2.1]octan-4-yl]piperidine-4-carboxamide
ID: Reference11228
Other Names: NAT17-347327
Formula: C20H29N3O5
Spectral Data
1-{(1S,2S,3S,4R,5R)-3-Hydroxy-2-[(4-methoxybenzyl)amino]-6,8-dioxabicyclo[3.2.1]oct-4-yl}-4-piperidinecarboxamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
| No. of Spectral Trees | 1 |
| No. of Spectra | 945 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 2/18/2022 8:27:07 AM |
Identificators
| InChI | InChI=1S/C20H29N3O5/c1-26-14-4-2-12(3-5-14)10-22-16-15-11-27-20(28-15)17(18(16)24)23-8-6-13(7-9-23)19(21)25/h2-5,13,15-18,20,22,24H,6-11H2,1H3,(H2,21,25)/t15-,16-,17-,18+,20-/m1/s1 |
| InChI Key | GRMXINZTMXDWTK-YFYQMDMQSA-N |
| Canonical SMILES | COC1=CC=C(C=C1)CNC2C3COC(O3)C(C2O)N4CCC(CC4)C(=O)N |
| CAS | |
| Splash | |
| Other Names | NAT17-347327 |