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

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Systematic / IUPAC Name: 4-Fluoro-N-[[(2R,3S,4R)-3-hydroxy-4-(pyridin-4-ylmethylamino)oxolan-2-yl]methyl]benzamide

ID: Reference11506

Other Names: D-Arabinitol, 1,4-anhydro-2,5-dideoxy-5-[(4-fluorobenzoyl)amino]-2-[(4-pyridinylmethyl)amino]-;
NAT19-554039

Formula: C18H20FN3O3

Spectral Data

1,4-Anhydro-2,5-dideoxy-5-[(4-fluorobenzoyl)amino]-2-[(4-pyridinylmethyl)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 1316
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 8/2/2022 8:28:27 AM
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Identificators

InChI InChI=1S/C18H20FN3O3/c19-14-3-1-13(2-4-14)18(24)22-10-16-17(23)15(11-25-16)21-9-12-5-7-20-8-6-12/h1-8,15-17,21,23H,9-11H2,(H,22,24)/t15-,16-,17+/m1/s1
InChI Key NQDJOKBDJLPWHB-ZACQAIPSSA-N
Canonical SMILES C1C(C(C(O1)CNC(=O)C2=CC=C(C=C2)F)O)NCC3=CC=NC=C3
CAS
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Other Names D-Arabinitol, 1,4-anhydro-2,5-dideoxy-5-[(4-fluorobenzoyl)amino]-2-[(4-pyridinylmethyl)amino]-;
NAT19-554039

In Other Databases

PubChem 75536825
ChemSpider 29858759