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3-(3-ketobutyl)-2-thioxo-1H-quinazolin-4-one

View entire compound with spectra: 1 NMR

3-(3-ketobutyl)-2-thioxo-1H-quinazolin-4-one
SpectraBase Compound ID 4Nt3hVbJZQ7
InChI InChI=1S/C12H12N2O2S/c1-8(15)6-7-14-11(16)9-4-2-3-5-10(9)13-12(14)17/h2-5H,6-7H2,1H3,(H,13,17)
InChIKey YKGMQNXRYVHUFI-UHFFFAOYSA-N
Mol Weight 248.3 g/mol
Molecular Formula C12H12N2O2S
Exact Mass 248.061949 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H7waAAmYL9r
Name 3-(3-ketobutyl)-2-thioxo-1H-quinazolin-4-one
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H12N2O2S
InChI InChI=1S/C12H12N2O2S/c1-8(15)6-7-14-11(16)9-4-2-3-5-10(9)13-12(14)17/h2-5H,6-7H2,1H3,(H,13,17)
InChIKey YKGMQNXRYVHUFI-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2010)
Molecular Weight 248.299 g/mol
Source File Reference MHKO26698