1,4-Anhydro-2,5-dideoxy-2-[(2,2-dimethylpropyl)amino]-5-{[(4-methylphenyl)sulfonyl]amino}-D-arabinitol

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

ID: Reference11562

Other Names: D-Arabinitol, 1,4-anhydro-2,5-dideoxy-2-[(2,2-dimethylpropyl)amino]-5-[[(4-methylphenyl)sulfonyl]amino]-;
NAT19-551664

Formula: C17H28N2O4S

Spectral Data

1,4-Anhydro-2,5-dideoxy-2-[(2,2-dimethylpropyl)amino]-5-{[(4-methylphenyl)sulfonyl]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 2741
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 7/15/2022 6:56:22 AM
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Identificators

InChI InChI=1S/C17H28N2O4S/c1-12-5-7-13(8-6-12)24(21,22)19-9-15-16(20)14(10-23-15)18-11-17(2,3)4/h5-8,14-16,18-20H,9-11H2,1-4H3/t14-,15-,16+/m1/s1
InChI Key RFVWPHUYUQMUMZ-OAGGEKHMSA-N
Canonical SMILES CC1=CC=C(C=C1)S(=O)(=O)NCC2C(C(CO2)NCC(C)(C)C)O
CAS
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Other Names D-Arabinitol, 1,4-anhydro-2,5-dideoxy-2-[(2,2-dimethylpropyl)amino]-5-[[(4-methylphenyl)sulfonyl]amino]-;
NAT19-551664

In Other Databases

PubChem 75536703
ChemSpider 29858618