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rac-5-Demethylxyloketal acetate

View entire compound with spectra: 1 MS (GC)

rac-5-Demethylxyloketal acetate
SpectraBase Compound ID 1tjmcJcOlr4
InChI InChI=1S/C20H24O6/c1-11(21)24-16-10-17-15(9-12-4-6-22-19(12,2)25-17)18-14(16)8-13-5-7-23-20(13,3)26-18/h10,12-13H,4-9H2,1-3H3/t12-,13-,19+,20+/m0/s1
InChIKey AFLLUKNKBMORMF-ISZNXKAUSA-N
Mol Weight 360.41 g/mol
Molecular Formula C20H24O6
Exact Mass 360.157288 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 61epBLIjFOa
Name rac-5-Demethylxyloketal acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24O6
InChI InChI=1S/C20H24O6/c1-11(21)24-16-10-17-15(9-12-4-6-22-19(12,2)25-17)18-14(16)8-13-5-7-23-20(13,3)26-18/h10,12-13H,4-9H2,1-3H3/t12-,13-,19+,20+/m0/s1
InChIKey AFLLUKNKBMORMF-ISZNXKAUSA-N
Molecular Weight 360.406 g/mol
SMILES c12c3c(O[C@@]4([C@](C3)(CCO4)[H])C)cc(c2C[C@]2([C@@](O1)(OCC2)C)[H])OC(=O)C
SPLASH splash10-01po-9368000000-a7e81a61adecb2ffaf95
Source of Spectrum K1-2004-1268-19
Wiley ID 1560564