1,4:3,6-Dianhydro-5-O-benzyl-2-deoxy-2-{[4-(trifluoromethyl)benzoyl]amino}-D-glucitol
10486
Reference
1,4:3,6-Dianhydro-5-O-benzyl-2-deoxy-2-{[4-(trifluoromethyl)benzoyl]amino}-D-glucitol Structure
Systematic / IUPAC Name: N-[(3S,3aR,6R,6aS)-6-Phenylmethoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]-4-(trifluoromethyl)benzamide
ID: Reference10486
Other Names: NAT6-304371
Formula: C21H20F3NO4
Spectral Data
1,4:3,6-Dianhydro-5-O-benzyl-2-deoxy-2-{[4-(trifluoromethyl)benzoyl]amino}-D-glucitol 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 | 1210 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 5/21/2021 12:43:43 PM |
Identificators
| InChI | InChI=1S/C21H20F3NO4/c22-21(23,24)15-8-6-14(7-9-15)20(26)25-16-11-28-19-17(12-29-18(16)19)27-10-13-4-2-1-3-5-13/h1-9,16-19H,10-12H2,(H,25,26)/t16-,17+,18+,19+/m0/s1 |
| InChI Key | PDCZGNOEJJKGFL-WJFTUGDTSA-N |
| Canonical SMILES | C1C(C2C(O1)C(CO2)OCC3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)C(F)(F)F |
| CAS | |
| Splash | |
| Other Names | NAT6-304371 |