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.alpha.-D-Glucofuranuronic acid, 5-(acetylamino)-5-deoxy-1,2-O-(1-methylethylidene)-, .gamma.-lactone
SpectraBase Compound ID 1khuAo4qmYz
InChI InChI=1S/C11H15NO6/c1-4(13)12-5-6-7(15-9(5)14)8-10(16-6)18-11(2,3)17-8/h5-8,10H,1-3H3,(H,12,13)/t5-,6+,7-,8+,10+/m0/s1
InChIKey PQVCLANOZSMNSM-RZWYQDGFSA-N
Mol Weight 257.24 g/mol
Molecular Formula C11H15NO6
Exact Mass 257.089937 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KzwTnEoDwB6
Name .alpha.-D-Glucofuranuronic acid, 5-(acetylamino)-5-deoxy-1,2-O-(1-methylethylidene)-, .gamma.-lactone
Alternate Name(s) 5-Acetamido-5-desoxy-1,2-O-isopropylidene-.alpha.-D-glucofuranurono-6,3-lactone Furo[2',3':4,5]furo[2,3-d]-1,3-dioxole, .alpha.-D-glucofuranuronic acid deriv. N-[(1S,2R,6R,8R,9S)-4,4-dimethyl-10-oxo-3,5,7,11-tetraoxatricyclo[6.3.0.0(2,6)]undecan-9-yl]acetamide
CAS Registry Number 52940-62-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H15NO6
InChI InChI=1S/C11H15NO6/c1-4(13)12-5-6-7(15-9(5)14)8-10(16-6)18-11(2,3)17-8/h5-8,10H,1-3H3,(H,12,13)/t5-,6+,7-,8+,10+/m0/s1
InChIKey PQVCLANOZSMNSM-RZWYQDGFSA-N
Molecular Weight 257.242 g/mol
SMILES N([C@]1([C@@]2([C@@]([C@@]3([C@@](OC(O3)(C)C)(O2)[H])[H])(OC1=O)[H])[H])[H])C(=O)C
SPLASH splash10-0006-9300000000-2c3c18659ef83a4f5492
Source of Spectrum H-65-1142-0
Wiley ID 1260578