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6-CARBOMETHOXY-3-METHYL-3-METHYLTHIOOXINDOL
SpectraBase Compound ID ApsfIpikBsl
InChI InChI=1S/C12H13NO3S/c1-12(17-3)8-5-4-7(10(14)16-2)6-9(8)13-11(12)15/h4-6H,1-3H3,(H,13,15)
InChIKey UMBKLFMLUSYECN-UHFFFAOYSA-N
Mol Weight 251.3 g/mol
Molecular Formula C12H13NO3S
Exact Mass 251.061614 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BHp9bOH4u1P
Name 6-CARBOMETHOXY-3-METHYL-3-METHYLTHIOOXINDOL
CAS Registry Number 61436-91-7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13NO3S
InChI InChI=1S/C12H13NO3S/c1-12(17-3)8-5-4-7(10(14)16-2)6-9(8)13-11(12)15/h4-6H,1-3H3,(H,13,15)
InChIKey UMBKLFMLUSYECN-UHFFFAOYSA-N
Literature Reference Author P.G.GASSMANN,D.P.GILBERT,T.Y.LUH
Literature Reference Citation J.ORG.CHEM.,42,1340(1977)
Literature Reference DOI 10.1021/jo00428a015
Molecular Weight 251.300 g/mol
Solvent DMSO
Source File Reference UNIW9318