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4-CARBETHOXY-3-METHYLTHIOOXINDOL

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4-CARBETHOXY-3-METHYLTHIOOXINDOL
SpectraBase Compound ID KkdoMJf4YLd
InChI InChI=1S/C12H13NO3S/c1-3-16-12(15)7-5-4-6-8-9(7)10(17-2)11(14)13-8/h4-6,10H,3H2,1-2H3,(H,13,14)
InChIKey XIFUQVBALSFERX-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 ptZK9NJJpw
Name 4-CARBETHOXY-3-METHYLTHIOOXINDOL
CAS Registry Number 61394-57-8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13NO3S
InChI InChI=1S/C12H13NO3S/c1-3-16-12(15)7-5-4-6-8-9(7)10(17-2)11(14)13-8/h4-6,10H,3H2,1-2H3,(H,13,14)
InChIKey XIFUQVBALSFERX-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 UNIW9301