1,4-Anhydro-2,5-dideoxy-2-(dimethylamino)-5-[(2-thienylcarbonyl)amino]-D-arabinitol

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Systematic / IUPAC Name: N-[[(2R,3S,4R)-4-(Dimethylamino)-3-hydroxyoxolan-2-yl]methyl]thiophene-2-carboxamide

ID: Reference11351

Other Names: D-Arabinitol, 1,4-anhydro-2,5-dideoxy-2-(dimethylamino)-5-[(2-thienylcarbonyl)amino]-;
NAT19-551303

Formula: C12H18N2O3S

Spectral Data

1,4-Anhydro-2,5-dideoxy-2-(dimethylamino)-5-[(2-thienylcarbonyl)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 705
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 4/14/2022 6:53:01 AM
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Identificators

InChI InChI=1S/C12H18N2O3S/c1-14(2)8-7-17-9(11(8)15)6-13-12(16)10-4-3-5-18-10/h3-5,8-9,11,15H,6-7H2,1-2H3,(H,13,16)/t8-,9-,11+/m1/s1
InChI Key NURCBIQEPKXAJF-KKZNHRDASA-N
Canonical SMILES CN(C)C1COC(C1O)CNC(=O)C2=CC=CS2
CAS
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Other Names D-Arabinitol, 1,4-anhydro-2,5-dideoxy-2-(dimethylamino)-5-[(2-thienylcarbonyl)amino]-;
NAT19-551303

In Other Databases

PubChem 75536590
ChEMBL CHEMBL3437299
ChemSpider 29858483