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D-erythro-Pentitol, 1,5-anhydro-3,4-dideoxy-3-[[(4-methylphenyl)sulfonyl]amino]-, 2-acetate
SpectraBase Compound ID 80SHLP9enXf
InChI InChI=1S/C14H19NO5S/c1-10-3-5-12(6-4-10)21(17,18)15-13-7-8-19-9-14(13)20-11(2)16/h3-6,13-15H,7-9H2,1-2H3
InChIKey NMVBYQQRAPRUNC-UHFFFAOYSA-N
Mol Weight 313.37 g/mol
Molecular Formula C14H19NO5S
Exact Mass 313.098394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Km2SISpq1O6
Name D-erythro-Pentitol, 1,5-anhydro-3,4-dideoxy-3-[[(4-methylphenyl)sulfonyl]amino]-, 2-acetate
CAS Registry Number 78294-51-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H19NO5S
InChI InChI=1S/C14H19NO5S/c1-10-3-5-12(6-4-10)21(17,18)15-13-7-8-19-9-14(13)20-11(2)16/h3-6,13-15H,7-9H2,1-2H3
InChIKey NMVBYQQRAPRUNC-UHFFFAOYSA-N
Molecular Weight 313.368 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)C1C(OC(=O)C)COCC1
SPLASH splash10-0nvj-2490000000-b6a383d6e9d3122f1255
Source of Spectrum K-114-1833-0
Synonyms 2-O-acetyl-1,5-anhydro-3,4-dideoxy-3-{[(4-methylphenyl)sulfonyl]amino}pentitol 3-Acetoxytetrahydro-4-(4-methylphenylsulfonylamino)pyran
Wiley ID 1314088