1,4-Anhydro-2,5-dideoxy-5-[(4-fluorobenzoyl)amino]-2-{[4-(methylsulfonyl)benzyl]amino}-D-arabinitol

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

ID: Reference11479

Other Names: D-Arabinitol, 1,4-anhydro-2,5-dideoxy-5-[(4-fluorobenzoyl)amino]-2-[[[4-(methylsulfonyl)phenyl]methyl]amino]-;
NAT19-551476

Formula: C20H23FN2O5S

Spectral Data

1,4-Anhydro-2,5-dideoxy-5-[(4-fluorobenzoyl)amino]-2-{[4-(methylsulfonyl)benzyl]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 2056
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 6/17/2022 7:44:52 AM
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Identificators

InChI InChI=1S/C20H23FN2O5S/c1-29(26,27)16-8-2-13(3-9-16)10-22-17-12-28-18(19(17)24)11-23-20(25)14-4-6-15(21)7-5-14/h2-9,17-19,22,24H,10-12H2,1H3,(H,23,25)/t17-,18-,19+/m1/s1
InChI Key JGKMIRYBNRQXSO-QRVBRYPASA-N
Canonical SMILES CS(=O)(=O)C1=CC=C(C=C1)CNC2COC(C2O)CNC(=O)C3=CC=C(C=C3)F
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Other Names D-Arabinitol, 1,4-anhydro-2,5-dideoxy-5-[(4-fluorobenzoyl)amino]-2-[[[4-(methylsulfonyl)phenyl]methyl]amino]-;
NAT19-551476

In Other Databases

ChemSpider 29858551
PubChem 75536644