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2,5-dimethyl-3a,4,7,7a-tetrahydroisoindole-1,3-quinone

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2,5-dimethyl-3a,4,7,7a-tetrahydroisoindole-1,3-quinone
SpectraBase Compound ID SpKgaoy5BR
InChI InChI=1S/C10H13NO2/c1-6-3-4-7-8(5-6)10(13)11(2)9(7)12/h3,7-8H,4-5H2,1-2H3
InChIKey ZHQBZFBHCNOGJF-UHFFFAOYSA-N
Mol Weight 179.22 g/mol
Molecular Formula C10H13NO2
Exact Mass 179.094629 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JroBFDwHg76
Name 2,5-dimethyl-3a,4,7,7a-tetrahydroisoindole-1,3-quinone
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H13NO2
InChI InChI=1S/C10H13NO2/c1-6-3-4-7-8(5-6)10(13)11(2)9(7)12/h3,7-8H,4-5H2,1-2H3
InChIKey ZHQBZFBHCNOGJF-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 179.219 g/mol
Source File Reference MHKO7691