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4,5-Dicarbethoxy-1-(.alpha.,.beta.-D-glucofuranos-3'-yl)-1,2,3-triazole
SpectraBase Compound ID 56jyhFpKzJH
InChI InChI=1S/C14H21N3O9/c1-3-24-12(21)7-8(13(22)25-4-2)17(16-15-7)9-10(19)6(5-18)26-14(23)11(9)20/h6,9-11,14,18-20,23H,3-5H2,1-2H3/t6?,9-,10+,11+,14?/m0/s1
InChIKey QRSXNEMYBANKCJ-VFIFFLAGSA-N
Mol Weight 375.33 g/mol
Molecular Formula C14H21N3O9
Exact Mass 375.127779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IQAeeQmQAon
Name 4,5-Dicarbethoxy-1-(.alpha.,.beta.-D-glucofuranos-3'-yl)-1,2,3-triazole
Alternate Name(s) 4,5-Diethyl 1-[(3R,4S,5S)-2,3,5-trihydroxy-6-(hydroxymethyl)oxan-4-yl]-1H-1,2,3-triazole-4,5-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H21N3O9
InChI InChI=1S/C14H21N3O9/c1-3-24-12(21)7-8(13(22)25-4-2)17(16-15-7)9-10(19)6(5-18)26-14(23)11(9)20/h6,9-11,14,18-20,23H,3-5H2,1-2H3/t6?,9-,10+,11+,14?/m0/s1
InChIKey QRSXNEMYBANKCJ-VFIFFLAGSA-N
Molecular Weight 375.334 g/mol
SMILES OC1OC([C@]([C@@]([C@]1(O)[H])([n]1c(c(C(=O)OCC)nn1)C(=O)OCC)[H])(O)[H])CO
SPLASH splash10-03xu-4980000000-de6aadfc6d87e4d63323
Source of Spectrum F-55-10519-15
Wiley ID 839014