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2-Methylsulfonylmethyl-3,4,5-triacetoxybenzyl methyl ether
SpectraBase Compound ID 9ZlTaW9Aqj1
InChI InChI=1S/C16H20O9S/c1-9(17)23-14-6-12(7-22-4)13(8-26(5,20)21)15(24-10(2)18)16(14)25-11(3)19/h6H,7-8H2,1-5H3
InChIKey CHKJWAVWUXAAQN-UHFFFAOYSA-N
Mol Weight 388.39 g/mol
Molecular Formula C16H20O9S
Exact Mass 388.082803 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9BVKV0Kq6uc
Name 2-Methylsulfonylmethyl-3,4,5-triacetoxybenzyl methyl ether
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O9S
InChI InChI=1S/C16H20O9S/c1-9(17)23-14-6-12(7-22-4)13(8-26(5,20)21)15(24-10(2)18)16(14)25-11(3)19/h6H,7-8H2,1-5H3
InChIKey CHKJWAVWUXAAQN-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 388.387 g/mol
SMILES COCc1cc(c(c(c1CS(C)(=O)=O)OC(C)=O)OC(C)=O)OC(C)=O
SPLASH splash10-016u-6981000000-8994faced32188efa36d
Source of Spectrum SRH-2022-6699-0
Wiley ID 1828521