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D-Ribitol, 1-[acetyl(3,4-dimethylphenyl)amino]-1-deoxy-, 2,3,4,5-tetraacetate
SpectraBase Compound ID IUvf54TSa7M
InChI InChI=1S/C23H31NO9/c1-13-8-9-20(10-14(13)2)24(15(3)25)11-21(31-17(5)27)23(33-19(7)29)22(32-18(6)28)12-30-16(4)26/h8-10,21-23H,11-12H2,1-7H3/t21-,22+,23-/m0/s1
InChIKey WYVCTULNJYKAEH-ZRBLBEILSA-N
Mol Weight 465.5 g/mol
Molecular Formula C23H31NO9
Exact Mass 465.199882 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3LJwZYm9oJz
Name D-Ribitol, 1-[acetyl(3,4-dimethylphenyl)amino]-1-deoxy-, 2,3,4,5-tetraacetate
CAS Registry Number 130543-40-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H31NO9
InChI InChI=1S/C23H31NO9/c1-13-8-9-20(10-14(13)2)24(15(3)25)11-21(31-17(5)27)23(33-19(7)29)22(32-18(6)28)12-30-16(4)26/h8-10,21-23H,11-12H2,1-7H3/t21-,22+,23-/m0/s1
InChIKey WYVCTULNJYKAEH-ZRBLBEILSA-N
Molecular Weight 465.499 g/mol
SMILES [C@]([C@@]([C@](OC(=O)C)(COC(=O)C)[H])(OC(=O)C)[H])(CN(c1cc(C)c(cc1)C)C(=O)C)(OC(=O)C)[H]
SPLASH splash10-00lr-0953400000-fc8c6854a58d9861e14a
Source of Spectrum F-46-4801-6
Synonyms 1-[acetyl(3,4-dimethylphenyl)amino]-1-deoxy-D-ribitol-2,3,4,5-tetraacetate 2,3,4,5-tetra-O-acetyl-1-(acetyl-3,4-dimethylanilino)-1-deoxy-D-ribitol
Wiley ID 1391708