1,4-Anhydro-2,5-dideoxy-5-[(4-fluorobenzoyl)amino]-2-[(2-fluorobenzyl)amino]-D-arabinitol

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Systematic / IUPAC Name: 4-Fluoro-N-[[(2R,3S,4R)-4-[(2-fluorophenyl)methylamino]-3-hydroxyoxolan-2-yl]methyl]benzamide

ID: Reference11483

Other Names: D-Arabinitol, 1,4-anhydro-2,5-dideoxy-5-[(4-fluorobenzoyl)amino]-2-[[(2-fluorophenyl)methyl]amino]-;
NAT19-551487

Formula: C19H20F2N2O3

Spectral Data

1,4-Anhydro-2,5-dideoxy-5-[(4-fluorobenzoyl)amino]-2-[(2-fluorobenzyl)amino]-D-arabinitol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 1721
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 6/22/2022 12:19:05 PM
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Identificators

InChI InChI=1S/C19H20F2N2O3/c20-14-7-5-12(6-8-14)19(25)23-10-17-18(24)16(11-26-17)22-9-13-3-1-2-4-15(13)21/h1-8,16-18,22,24H,9-11H2,(H,23,25)/t16-,17-,18+/m1/s1
InChI Key LWHRSXTTZJSQQJ-KURKYZTESA-N
Canonical SMILES C1C(C(C(O1)CNC(=O)C2=CC=C(C=C2)F)O)NCC3=CC=CC=C3F
CAS
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Other Names D-Arabinitol, 1,4-anhydro-2,5-dideoxy-5-[(4-fluorobenzoyl)amino]-2-[[(2-fluorophenyl)methyl]amino]-;
NAT19-551487

In Other Databases

PubChem 75536649
ChemSpider 29858557
ChEMBL CHEMBL3437351