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

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Systematic / IUPAC Name: N-[4-[[[(3R,4S,5R)-4-Hydroxy-5-[[(4-methylphenyl)sulfonylamino]methyl]oxolan-3-yl]amino]methyl]phenyl]acetamide

ID: Reference11509

Other Names: D-Arabinitol, 2-[[[4-(acetylamino)phenyl]methyl]amino]-1,4-anhydro-2,5-dideoxy-5-[[(4-methylphenyl)sulfonyl]amino]-;
NAT19-551672

Formula: C21H27N3O5S

Spectral Data

2-[(4-Acetamidobenzyl)amino]-1,4-anhydro-2,5-dideoxy-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 1528
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 6/28/2022 8:41:02 AM
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Identificators

InChI InChI=1S/C21H27N3O5S/c1-14-3-9-18(10-4-14)30(27,28)23-12-20-21(26)19(13-29-20)22-11-16-5-7-17(8-6-16)24-15(2)25/h3-10,19-23,26H,11-13H2,1-2H3,(H,24,25)/t19-,20-,21+/m1/s1
InChI Key BSQRNABSMFSYAP-NJYVYQBISA-N
Canonical SMILES CC1=CC=C(C=C1)S(=O)(=O)NCC2C(C(CO2)NCC3=CC=C(C=C3)NC(=O)C)O
CAS
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Other Names D-Arabinitol, 2-[[[4-(acetylamino)phenyl]methyl]amino]-1,4-anhydro-2,5-dideoxy-5-[[(4-methylphenyl)sulfonyl]amino]-;
NAT19-551672

In Other Databases

PubChem 75536710
ChemSpider 29858625