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{7-[(Methylsulfonyl)oxy]-2,3-dihydro-1,4-benzodioxin-2-yl}methyl 4-methylbenzenesulfonate
SpectraBase Compound ID JNC2QdM3xE0
InChI InChI=1S/C17H18O8S2/c1-12-3-6-15(7-4-12)27(20,21)23-11-14-10-22-16-8-5-13(9-17(16)24-14)25-26(2,18)19/h3-9,14H,10-11H2,1-2H3
InChIKey MYBLGYURGISNPB-UHFFFAOYSA-N
Mol Weight 414.44 g/mol
Molecular Formula C17H18O8S2
Exact Mass 414.04431 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3iEYITsXGwh
Name {7-[(Methylsulfonyl)oxy]-2,3-dihydro-1,4-benzodioxin-2-yl}methyl 4-methylbenzenesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O8S2
InChI InChI=1S/C17H18O8S2/c1-12-3-6-15(7-4-12)27(20,21)23-11-14-10-22-16-8-5-13(9-17(16)24-14)25-26(2,18)19/h3-9,14H,10-11H2,1-2H3
InChIKey MYBLGYURGISNPB-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 414.443 g/mol
SMILES c1(OS(C)(=O)=O)cc2c(OCC(COS(c3ccc(C)cc3)(=O)=O)O2)cc1
SPLASH splash10-06rl-5809500000-f317855ccb8a8dc2c23e
Source of Spectrum US20110105462A1
Wiley ID 1844360