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WACGBIIVXYSEFZ-UHFFFAOYSA-N

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WACGBIIVXYSEFZ-UHFFFAOYSA-N
SpectraBase Compound ID BLAMMmuiO1N
InChI InChI=1S/C15H13IO3S/c1-11-2-4-12(5-3-11)15(17)10-20(18,19)14-8-6-13(16)7-9-14/h2-9H,10H2,1H3
InChIKey WACGBIIVXYSEFZ-UHFFFAOYSA-N
Mol Weight 400.23 g/mol
Molecular Formula C15H13IO3S
Exact Mass 399.96301 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7rF4UI9Gnn
Name WACGBIIVXYSEFZ-UHFFFAOYSA-N
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H13IO3S
InChI InChI=1S/C15H13IO3S/c1-11-2-4-12(5-3-11)15(17)10-20(18,19)14-8-6-13(16)7-9-14/h2-9H,10H2,1H3
InChIKey WACGBIIVXYSEFZ-UHFFFAOYSA-N
Literature Reference Author R.GAWINECKI,E.KOLEHMAINEN,A.ZAKRZEWSKI,K.LAIHIA,B.OSMIALOWSK I,R.KAUPPINEN
Literature Reference Citation MAGN.RES.CHEM.,37,437(1999)
Literature Reference DOI 10.1002/(sici)1097-458x(199906)37:6<437::aid-mrc470>3.0.co;2-3
Molecular Weight 400.231 g/mol
Solvent CD3CN
Source File Reference UWCS23014