5-O-(2-Amino-2-oxoethyl)-1,4:3,6-dianhydro-2-{[(2-cyanophenyl)sulfonyl]amino}-2-deoxy-D-glucitol

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Systematic / IUPAC Name: 2-[[(3S,3aR,6R,6aS)-3-[(2-Cyanophenyl)sulfonylamino]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]oxy]acetamide

ID: Reference12017

Other Names: D-Glucitol, 5-O-(2-amino-2-oxoethyl)-1,4:3,6-dianhydro-2-[[(2-cyanophenyl)sulfonyl]amino]-2-deoxy-;
NAT6-269395

Formula: C15H17N3O6S

Spectral Data

5-O-(2-Amino-2-oxoethyl)-1,4:3,6-dianhydro-2-{[(2-cyanophenyl)sulfonyl]amino}-2-deoxy-D-glucitol 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 1713
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 12/2/2022 8:59:46 AM
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Identificators

InChI InChI=1S/C15H17N3O6S/c16-5-9-3-1-2-4-12(9)25(20,21)18-10-6-23-15-11(7-24-14(10)15)22-8-13(17)19/h1-4,10-11,14-15,18H,6-8H2,(H2,17,19)/t10-,11+,14+,15+/m0/s1
InChI Key HQXNJVWIZWPDRC-RBDSIQFVSA-N
Canonical SMILES C1C(C2C(O1)C(CO2)OCC(=O)N)NS(=O)(=O)C3=CC=CC=C3C#N
CAS
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Other Names D-Glucitol, 5-O-(2-amino-2-oxoethyl)-1,4:3,6-dianhydro-2-[[(2-cyanophenyl)sulfonyl]amino]-2-deoxy-;
NAT6-269395

In Other Databases

PubChem 11883291
ChemSpider 10057619