Systematic / IUPAC Name: 4-Fluoro-N-[[(2R,3S,4R)-3-hydroxy-4-(oxetan-3-ylamino)oxolan-2-yl]methyl]benzamide
ID: Reference12025
Other Names:
D-Arabinitol, 1,4-anhydro-2,5-dideoxy-5-[(4-fluorobenzoyl)amino]-2-(3-oxetanylamino)-;
NAT19-554035
Formula: C15H19FN2O4
1,4-Anhydro-2,5-dideoxy-5-[(4-fluorobenzoyl)amino]-2-(3-oxetanylamino)-D-arabinitol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
No. of Spectral Trees | 1 |
No. of Spectra | 1297 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 12/6/2022 8:00:34 AM |
InChI | InChI=1S/C15H19FN2O4/c16-10-3-1-9(2-4-10)15(20)17-5-13-14(19)12(8-22-13)18-11-6-21-7-11/h1-4,11-14,18-19H,5-8H2,(H,17,20)/t12-,13-,14+/m1/s1 |
InChI Key | XMSZYHSAQPBRBR-MCIONIFRSA-N |
Canonical SMILES | C1C(CO1)NC2COC(C2O)CNC(=O)C3=CC=C(C=C3)F |
CAS | |
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Other Names |
D-Arabinitol, 1,4-anhydro-2,5-dideoxy-5-[(4-fluorobenzoyl)amino]-2-(3-oxetanylamino)-; NAT19-554035 |