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METHYL-2-AMINO-4-(2-(1,3-DIHYDRO-1,3-DIOXO-2H-ISOINDOL-2-YL)-ETHYL)-THIOPHENE-3-CARBOXYLATE
SpectraBase Compound ID 6MjKTVyPPgA
InChI InChI=1S/C16H14N2O4S/c1-22-16(21)12-9(8-23-13(12)17)6-7-18-14(19)10-4-2-3-5-11(10)15(18)20/h2-5,8H,6-7,17H2,1H3
InChIKey PQWYNILCDABNKP-UHFFFAOYSA-N
Mol Weight 330.36 g/mol
Molecular Formula C16H14N2O4S
Exact Mass 330.067428 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LcB0nzLbQ03
Name METHYL-2-AMINO-4-(2-(1,3-DIHYDRO-1,3-DIOXO-2H-ISOINDOL-2-YL)-ETHYL)-THIOPHENE-3-CARBOXYLATE
Compound Number 9A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H14N2O4S
InChI InChI=1S/C16H14N2O4S/c1-22-16(21)12-9(8-23-13(12)17)6-7-18-14(19)10-4-2-3-5-11(10)15(18)20/h2-5,8H,6-7,17H2,1H3
InChIKey PQWYNILCDABNKP-UHFFFAOYSA-N
Literature Reference Author H.P.BUCHSTALLER,C.D.SIEBERT,R.H.LYSSY,I.FRANK,A.DURAN,R.GOTT SCHLICH,C.R.NOE
Literature Reference Citation MH.CHEM.,132,279(2001)
Literature Reference DOI 10.1007/s007060170137
Molecular Weight 330.358 g/mol
Solvent CDCl3
Source File Reference UWSI3729