1,4-Anhydro-2-[(3-cyanobenzyl)amino]-2,5-dideoxy-5-[(methylsulfonyl)amino]-D-arabinitol

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

ID: Reference11936

Other Names: D-Arabinitol, 1,4-anhydro-2-[[(3-cyanophenyl)methyl]amino]-2,5-dideoxy-5-[(methylsulfonyl)amino]-;
NAT19-551536

Formula: C14H19N3O4S

Spectral Data

1,4-Anhydro-2-[(3-cyanobenzyl)amino]-2,5-dideoxy-5-[(methylsulfonyl)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 1795
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 11/11/2022 1:56:06 PM
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Identificators

InChI InChI=1S/C14H19N3O4S/c1-22(19,20)17-8-13-14(18)12(9-21-13)16-7-11-4-2-3-10(5-11)6-15/h2-5,12-14,16-18H,7-9H2,1H3/t12-,13-,14+/m1/s1
InChI Key SNNMFFODOBYWNA-MCIONIFRSA-N
Canonical SMILES CS(=O)(=O)NCC1C(C(CO1)NCC2=CC(=CC=C2)C#N)O
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Other Names D-Arabinitol, 1,4-anhydro-2-[[(3-cyanophenyl)methyl]amino]-2,5-dideoxy-5-[(methylsulfonyl)amino]-;
NAT19-551536

In Other Databases

PubChem 75536671
ChemSpider 29858582