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

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

ID: Reference11328

Other Names: D-Arabinitol, 1,4-anhydro-5-[(cyclopentylcarbonyl)amino]-2,5-dideoxy-2-[[[4-(methylsulfonyl)phenyl]methyl]amino]-;
NAT19-551226

Formula: C19H28N2O5S

Spectral Data

1,4-Anhydro-5-[(cyclopentylcarbonyl)amino]-2,5-dideoxy-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 2215
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 4/1/2022 9:16:01 AM
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Identificators

InChI InChI=1S/C19H28N2O5S/c1-27(24,25)15-8-6-13(7-9-15)10-20-16-12-26-17(18(16)22)11-21-19(23)14-4-2-3-5-14/h6-9,14,16-18,20,22H,2-5,10-12H2,1H3,(H,21,23)/t16-,17-,18+/m1/s1
InChI Key AAQMYXGDTZFTOP-KURKYZTESA-N
Canonical SMILES CS(=O)(=O)C1=CC=C(C=C1)CNC2COC(C2O)CNC(=O)C3CCCC3
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Other Names D-Arabinitol, 1,4-anhydro-5-[(cyclopentylcarbonyl)amino]-2,5-dideoxy-2-[[[4-(methylsulfonyl)phenyl]methyl]amino]-;
NAT19-551226

In Other Databases

PubChem 75536564
ChemSpider 29858453