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

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

ID: Reference11542

Other Names: D-Arabinitol, 1,4-anhydro-2,5-dideoxy-5-[(4-fluorobenzoyl)amino]-2-[(2-thienylmethyl)amino]-;
NAT19-551497

Formula: C17H19FN2O3S

Spectral Data

1,4-Anhydro-2,5-dideoxy-5-[(4-fluorobenzoyl)amino]-2-[(2-thienylmethyl)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 710
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 7/8/2022 6:46:35 AM
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Identificators

InChI InChI=1S/C17H19FN2O3S/c18-12-5-3-11(4-6-12)17(22)20-9-15-16(21)14(10-23-15)19-8-13-2-1-7-24-13/h1-7,14-16,19,21H,8-10H2,(H,20,22)/t14-,15-,16+/m1/s1
InChI Key CLJQQZFWRMHMLQ-OAGGEKHMSA-N
Canonical SMILES C1C(C(C(O1)CNC(=O)C2=CC=C(C=C2)F)O)NCC3=CC=CS3
CAS
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Other Names D-Arabinitol, 1,4-anhydro-2,5-dideoxy-5-[(4-fluorobenzoyl)amino]-2-[(2-thienylmethyl)amino]-;
NAT19-551497

In Other Databases

PubChem 75536650
ChemSpider 29858558