(1S,2S,3S,4R,5R)-2-Amino-4-[4-(2-methoxyphenyl)-1-piperazinyl]-6,8-dioxabicyclo[3.2.1]octan-3-ol
12121
Reference
(1S,2S,3S,4R,5R)-2-Amino-4-[4-(2-methoxyphenyl)-1-piperazinyl]-6,8-dioxabicyclo[3.2.1]octan-3-ol Structure
Systematic / IUPAC Name: (1S,2S,3S,4R,5R)-2-Amino-4-[4-(2-methoxyphenyl)piperazin-1-yl]-6,8-dioxabicyclo[3.2.1]octan-3-ol
ID: Reference12121
Other Names: NAT17-347130
Formula: C17H25N3O4
Spectral Data
(1S,2S,3S,4R,5R)-2-Amino-4-[4-(2-methoxyphenyl)-1-piperazinyl]-6,8-dioxabicyclo[3.2.1]octan-3-ol 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 | 1930 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 1/13/2023 8:29:26 AM |
Identificators
| InChI | InChI=1S/C17H25N3O4/c1-22-12-5-3-2-4-11(12)19-6-8-20(9-7-19)15-16(21)14(18)13-10-23-17(15)24-13/h2-5,13-17,21H,6-10,18H2,1H3/t13-,14-,15-,16+,17-/m1/s1 |
| InChI Key | VTVLARKVJSPAHU-OVYGPGRDSA-N |
| Canonical SMILES | COC1=CC=CC=C1N2CCN(CC2)C3C(C(C4COC3O4)N)O |
| CAS | |
| Splash | |
| Other Names | NAT17-347130 |