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GTAJSAVAQHWQPN-UHFFFAOYSA-N
SpectraBase Compound ID 9WgdLRN9Pmu
InChI InChI=1S/C19H22O9S/c1-25-14-7-5-13(9-17(14)27-3)19(21)18(11-29(22,23)24)28-15-6-4-12(10-20)8-16(15)26-2/h4-9,18,20H,10-11H2,1-3H3,(H,22,23,24)
InChIKey GTAJSAVAQHWQPN-UHFFFAOYSA-N
Mol Weight 426.44 g/mol
Molecular Formula C19H22O9S
Exact Mass 426.098453 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DxeDDALRJBg
Name GTAJSAVAQHWQPN-UHFFFAOYSA-N
Compound Number 21
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H22O9S
InChI InChI=1S/C19H22O9S/c1-25-14-7-5-13(9-17(14)27-3)19(21)18(11-29(22,23)24)28-15-6-4-12(10-20)8-16(15)26-2/h4-9,18,20H,10-11H2,1-3H3,(H,22,23,24)
InChIKey GTAJSAVAQHWQPN-UHFFFAOYSA-N
Literature Reference Author B.L.LUTNAES,B.O.MYRVOLD,R.A.LAUTEN,M.M.ENDESHAW
Literature Reference Citation MAGN.RES.CHEM.,46,299(2008)
Literature Reference DOI 10.1002/mrc.2184
Molecular Weight 426.438 g/mol
Solvent CD3OD
Source File Reference UWIR17233