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ethanethioic acid S-[2-[[4-(isobutylcarbamoyl)phenyl]amino]-2-keto-ethyl] ester

View entire compound with spectra: 1 NMR

ethanethioic acid S-[2-[[4-(isobutylcarbamoyl)phenyl]amino]-2-keto-ethyl] ester
SpectraBase Compound ID DOKYQBD6m7v
InChI InChI=1S/C15H20N2O3S/c1-10(2)8-16-15(20)12-4-6-13(7-5-12)17-14(19)9-21-11(3)18/h4-7,10H,8-9H2,1-3H3,(H,16,20)(H,17,19)
InChIKey WPYUWJNMTQMKQT-UHFFFAOYSA-N
Mol Weight 308.4 g/mol
Molecular Formula C15H20N2O3S
Exact Mass 308.119464 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 38RZjPJPNRK
Name ethanethioic acid S-[2-[[4-(isobutylcarbamoyl)phenyl]amino]-2-keto-ethyl] ester
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H20N2O3S
InChI InChI=1S/C15H20N2O3S/c1-10(2)8-16-15(20)12-4-6-13(7-5-12)17-14(19)9-21-11(3)18/h4-7,10H,8-9H2,1-3H3,(H,16,20)(H,17,19)
InChIKey WPYUWJNMTQMKQT-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 308.395 g/mol
Source File Reference MHKO20109