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2-[4-(dimethyl-$l^{4}-sulfanylidene)-3-keto-butyl]-4-nitro-isoindoline-1,3-quinone
SpectraBase Compound ID JQlIKEgB033
InChI InChI=1S/C14H14N2O5S/c1-22(2)8-9(17)6-7-15-13(18)10-4-3-5-11(16(20)21)12(10)14(15)19/h3-5,8H,6-7H2,1-2H3
InChIKey NIJYONZYMQLDML-UHFFFAOYSA-N
Mol Weight 322.34 g/mol
Molecular Formula C14H14N2O5S
Exact Mass 322.062343 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BB9gZpmy9lb
Name 2-[4-(dimethyl-$l^{4}-sulfanylidene)-3-keto-butyl]-4-nitro-isoindoline-1,3-quinone
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H14N2O5S
InChI InChI=1S/C14H14N2O5S/c1-22(2)8-9(17)6-7-15-13(18)10-4-3-5-11(16(20)21)12(10)14(15)19/h3-5,8H,6-7H2,1-2H3
InChIKey NIJYONZYMQLDML-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2008)
Molecular Weight 322.336 g/mol
Source File Reference MHKO17627