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3-Deoxy-1,2-O-isopropylidene-5-O-methanesulfonyl-3-C-[2-(4-methoxybenzyloxy(ethyl]-.alpha.-D-allofuranose
SpectraBase Compound ID 4wIYdj1UExn
InChI InChI=1S/C20H30O9S/c1-20(2)27-18-15(9-10-25-12-13-5-7-14(24-3)8-6-13)17(26-19(18)28-20)16(11-21)29-30(4,22)23/h5-8,15-19,21H,9-12H2,1-4H3/t15-,16-,17?,18-,19-/m1/s1
InChIKey ZGSSHAUYDFBRMY-JYWIRNALSA-N
Mol Weight 446.51 g/mol
Molecular Formula C20H30O9S
Exact Mass 446.161054 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EfVPltzf5Lf
Name 3-Deoxy-1,2-O-isopropylidene-5-O-methanesulfonyl-3-C-[2-(4-methoxybenzyloxy(ethyl]-.alpha.-D-allofuranose
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O9S
InChI InChI=1S/C20H30O9S/c1-20(2)27-18-15(9-10-25-12-13-5-7-14(24-3)8-6-13)17(26-19(18)28-20)16(11-21)29-30(4,22)23/h5-8,15-19,21H,9-12H2,1-4H3/t15-,16-,17?,18-,19-/m1/s1
InChIKey ZGSSHAUYDFBRMY-JYWIRNALSA-N
Molecular Weight 446.511 g/mol
SMILES OC[C@](C1O[C@]2([C@@]([C@@]1(CCOCc1ccc(cc1)OC)[H])(OC(O2)(C)C)[H])[H])(OS(=O)(=O)C)[H]
SPLASH splash10-0006-9210000000-01fbf6ba344866ff4f60
Source of Spectrum E1-39-69-16
Wiley ID 1518640