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2-[(2-isopropyl-5-methyl-cyclohexoxy)carbonylamino]propanedithioic acid ethyl ester
SpectraBase Compound ID yqfpZTFdO2
InChI InChI=1S/C16H29NO2S2/c1-6-21-15(20)12(5)17-16(18)19-14-9-11(4)7-8-13(14)10(2)3/h10-14H,6-9H2,1-5H3,(H,17,18)
InChIKey WPKGJOMVBJWUBV-UHFFFAOYSA-N
Mol Weight 331.53 g/mol
Molecular Formula C16H29NO2S2
Exact Mass 331.163972 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6aiVHG36FlW
Name 2-[(2-isopropyl-5-methyl-cyclohexoxy)carbonylamino]propanedithioic acid ethyl ester
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H29NO2S2
InChI InChI=1S/C16H29NO2S2/c1-6-21-15(20)12(5)17-16(18)19-14-9-11(4)7-8-13(14)10(2)3/h10-14H,6-9H2,1-5H3,(H,17,18)
InChIKey WPKGJOMVBJWUBV-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight 331.532 g/mol
Source File Reference MHKO16264