1-{(1S,2S,3S,4R,5R)-2-[(4-Biphenylylmethyl)amino]-3-hydroxy-6,8-dioxabicyclo[3.2.1]oct-4-yl}-4-piperidinecarboxamide
11890
Reference
1-{(1S,2S,3S,4R,5R)-2-[(4-Biphenylylmethyl)amino]-3-hydroxy-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-phenylphenyl)methylamino]-6,8-dioxabicyclo[3.2.1]octan-4-yl]piperidine-4-carboxamide
ID: Reference11890
Other Names: NAT17-347328
Formula: C25H31N3O4
Spectral Data
1-{(1S,2S,3S,4R,5R)-2-[(4-Biphenylylmethyl)amino]-3-hydroxy-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 | 1420 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 10/31/2022 12:37:56 PM |
Identificators
| InChI | InChI=1S/C25H31N3O4/c26-24(30)19-10-12-28(13-11-19)22-23(29)21(20-15-31-25(22)32-20)27-14-16-6-8-18(9-7-16)17-4-2-1-3-5-17/h1-9,19-23,25,27,29H,10-15H2,(H2,26,30)/t20-,21-,22-,23+,25-/m1/s1 |
| InChI Key | FZTQRIIDSYCUEZ-COWNTTACSA-N |
| Canonical SMILES | C1CN(CCC1C(=O)N)C2C(C(C3COC2O3)NCC4=CC=C(C=C4)C5=CC=CC=C5)O |
| CAS | |
| Splash | |
| Other Names | NAT17-347328 |