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D-ribo-Hexonic acid, 2,5-anhydro-3-deoxy-, methyl ester, 4-(4-methylbenzoate)
SpectraBase Compound ID FRZo5Rfnpdf
InChI InChI=1S/C15H18O6/c1-10-3-5-12(6-4-10)14(18)20-13-7-15(9-16,19-8-13)21-11(2)17/h3-6,13,16H,7-9H2,1-2H3/t13-,15-/m0/s1
InChIKey XSXZQMGGETZCJM-ZFWWWQNUSA-N
Mol Weight 294.3 g/mol
Molecular Formula C15H18O6
Exact Mass 294.110338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9JQl5OkRt3T
Name D-ribo-Hexonic acid, 2,5-anhydro-3-deoxy-, methyl ester, 4-(4-methylbenzoate)
CAS Registry Number 79827-65-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O6
InChI InChI=1S/C15H18O6/c1-10-3-5-12(6-4-10)14(18)20-13-7-15(9-16,19-8-13)21-11(2)17/h3-6,13,16H,7-9H2,1-2H3/t13-,15-/m0/s1
InChIKey XSXZQMGGETZCJM-ZFWWWQNUSA-N
Molecular Weight 294.303 g/mol
SMILES OC[C@]1(C[C@](OC(c2ccc(cc2)C)=O)(CO1)[H])OC(=O)C
SPLASH splash10-014i-1900000000-4b3de27a0ebf835fe4b8
Source of Spectrum J-47-196-0
Synonyms 1-(carbomethoxy)-2-deoxy-3-O-p-toluoyl-.beta.-D-erythropentofuranose 2-O-acetyl-3-deoxy-4-O-(4-methylbenzoyl)-.alpha.-D-glycero-pent-2-ulofuranose
Wiley ID 1296962