2-[(4-Acetamidobenzyl)amino]-1,4-anhydro-2,5-dideoxy-5-[(phenylsulfonyl)amino]-D-arabinitol

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Systematic / IUPAC Name: N-[4-[[[(3R,4S,5R)-5-(Benzenesulfonamidomethyl)-4-hydroxyoxolan-3-yl]amino]methyl]phenyl]acetamide

ID: Reference11500

Other Names: D-Arabinitol, 2-[[[4-(acetylamino)phenyl]methyl]amino]-1,4-anhydro-2,5-dideoxy-5-[(phenylsulfonyl)amino]-;
NAT19-551622

Formula: C20H25N3O5S

Spectral Data

2-[(4-Acetamidobenzyl)amino]-1,4-anhydro-2,5-dideoxy-5-[(phenylsulfonyl)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 1394
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 6/23/2022 2:22:53 PM
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Identificators

InChI InChI=1S/C20H25N3O5S/c1-14(24)23-16-9-7-15(8-10-16)11-21-18-13-28-19(20(18)25)12-22-29(26,27)17-5-3-2-4-6-17/h2-10,18-22,25H,11-13H2,1H3,(H,23,24)/t18-,19-,20+/m1/s1
InChI Key UNQZYXDXNXZGCQ-AQNXPRMDSA-N
Canonical SMILES CC(=O)NC1=CC=C(C=C1)CNC2COC(C2O)CNS(=O)(=O)C3=CC=CC=C3
CAS
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Other Names D-Arabinitol, 2-[[[4-(acetylamino)phenyl]methyl]amino]-1,4-anhydro-2,5-dideoxy-5-[(phenylsulfonyl)amino]-;
NAT19-551622

In Other Databases

PubChem 75536685
ChemSpider 29858599