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2-(cyclopentoxycarbonylamino)propanedithioic acid benzyl ester

View entire compound with spectra: 1 NMR

2-(cyclopentoxycarbonylamino)propanedithioic acid benzyl ester
SpectraBase Compound ID 85AKoLg0kvX
InChI InChI=1S/C16H21NO2S2/c1-12(17-16(18)19-14-9-5-6-10-14)15(20)21-11-13-7-3-2-4-8-13/h2-4,7-8,12,14H,5-6,9-11H2,1H3,(H,17,18)
InChIKey DPHKGDGJCZHWEL-UHFFFAOYSA-N
Mol Weight 323.47 g/mol
Molecular Formula C16H21NO2S2
Exact Mass 323.101371 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FebrHeiMhjV
Name 2-(cyclopentoxycarbonylamino)propanedithioic acid benzyl ester
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H21NO2S2
InChI InChI=1S/C16H21NO2S2/c1-12(17-16(18)19-14-9-5-6-10-14)15(20)21-11-13-7-3-2-4-8-13/h2-4,7-8,12,14H,5-6,9-11H2,1H3,(H,17,18)
InChIKey DPHKGDGJCZHWEL-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight 323.468 g/mol
Source File Reference MHKO16261