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1-S-[(1E)-N-Hydroxy-3-phenylpropanimidoyl]-1-thiohexopyranose
SpectraBase Compound ID 6WnqO3wq7NW
InChI InChI=1S/C15H21NO6S/c17-8-10-12(18)13(19)14(20)15(22-10)23-11(16-21)7-6-9-4-2-1-3-5-9/h1-5,10,12-15,17-21H,6-8H2/b16-11+
InChIKey HJUSVMWTCVFYOA-LFIBNONCSA-N
Mol Weight 343.39 g/mol
Molecular Formula C15H21NO6S
Exact Mass 343.108959 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IyhI8xaA8us
Name 1-S-[(1E)-N-Hydroxy-3-phenylpropanimidoyl]-1-thiohexopyranose
CAS Registry Number 77171-31-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H21NO6S
InChI InChI=1S/C15H21NO6S/c17-8-10-12(18)13(19)14(20)15(22-10)23-11(16-21)7-6-9-4-2-1-3-5-9/h1-5,10,12-15,17-21H,6-8H2/b16-11+
InChIKey HJUSVMWTCVFYOA-LFIBNONCSA-N
Molecular Weight 343.394 g/mol
SMILES OCC1OC(C(C(C1O)O)O)S\C(CCc1ccccc1)=N/O
SPLASH splash10-0006-9300000000-cad1c7fbd931a8415d58
Source of Spectrum W5-1989-8544-1
Synonyms (1E)-N-hydroxy-3-phenyl-thiopropionimidic acid (3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl) ester .beta.-D-Glucopyranose, 1-thio-, 1-(N-hydroxybenzenepropanimidate) (1E)-N-hydroxy-3-phenylpropanimidothioic acid [3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl] ester [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1E)-N-hydroxy-3-phenylpropanimidothioate [3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl] (1E)-N-hydroxy-3-phenyl-propanimidothioate
Wiley ID 1337152