(1S)-1,5-Anhydro-6-(cyclohexylamino)-2,3,6-trideoxy-1-[(5-phenyl-1,2-oxazol-3-yl)methyl]-D-erythro-hexitol
11163
Reference
(1S)-1,5-Anhydro-6-(cyclohexylamino)-2,3,6-trideoxy-1-[(5-phenyl-1,2-oxazol-3-yl)methyl]-D-erythro-hexitol Structure
Systematic / IUPAC Name: (2R,3S,6S)-2-[(Cyclohexylamino)methyl]-6-[(5-phenyl-1,2-oxazol-3-yl)methyl]oxan-3-ol
ID: Reference11163
Other Names: NAT12-540532
Formula: C22H30N2O3
Spectral Data
(1S)-1,5-Anhydro-6-(cyclohexylamino)-2,3,6-trideoxy-1-[(5-phenyl-1,2-oxazol-3-yl)methyl]-D-erythro-hexitol 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 | 2325 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 1/28/2022 8:18:48 AM |
Identificators
| InChI | InChI=1S/C22H30N2O3/c25-20-12-11-19(26-22(20)15-23-17-9-5-2-6-10-17)13-18-14-21(27-24-18)16-7-3-1-4-8-16/h1,3-4,7-8,14,17,19-20,22-23,25H,2,5-6,9-13,15H2/t19-,20-,22+/m0/s1 |
| InChI Key | RMCDARNYWLHGGW-JAXLGGSGSA-N |
| Canonical SMILES | C1CCC(CC1)NCC2C(CCC(O2)CC3=NOC(=C3)C4=CC=CC=C4)O |
| CAS | |
| Splash | |
| Other Names | NAT12-540532 |