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XEMSMURDPSPELW-SREVYHEPSA-N
SpectraBase Compound ID F3FwahPGZqv
InChI InChI=1S/C8H14OS2/c1-3-4-5-11-8(9)6-7(2)10/h6,10H,3-5H2,1-2H3/b7-6-
InChIKey XEMSMURDPSPELW-SREVYHEPSA-N
Mol Weight 190.32 g/mol
Molecular Formula C8H14OS2
Exact Mass 190.048607 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2y8K9D5ZEH5
Name 3-Thioxo-thiobutyric acid, S-butyl ester
Comments (Z)-ENETHIOL FORM, (E)-ENETHIOL SIGNALS AT 168.8(C1), 120.9(C2) PPM
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H14OS2
InChI InChI=1S/C8H14OS2/c1-3-4-5-11-8(9)6-7(2)10/h6,10H,3-5H2,1-2H3/b7-6-
InChIKey XEMSMURDPSPELW-SREVYHEPSA-N
Instrument Name Jeol FX-90
Literature Reference F. Duns, P.E. Hansen, Org. Magn. Resonance 22, 16 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3