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S-TERT.-BUTYL-2-CHLOROTHIOLACETAT
SpectraBase Compound ID Jtve83ne8TA
InChI InChI=1S/C7H13ClOS/c1-5(8)6(9)10-7(2,3)4/h5H,1-4H3
InChIKey JNBLWIWVZFKKAY-UHFFFAOYSA-N
Mol Weight 180.69 g/mol
Molecular Formula C7H13ClOS
Exact Mass 180.037564 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JLSzP47Xl3Q
Name 2-CHLOROTHIOPROPIONIC ACID, S-tert-BUTYL ESTER
Source of Sample C. M. Hall, J. Wemple J. Org. Chem. 42, 2118 (1977)
CAS Registry Number 56377-47-0
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H13ClOS
InChI InChI=1S/C7H13ClOS/c1-5(8)6(9)10-7(2,3)4/h5H,1-4H3
InChIKey JNBLWIWVZFKKAY-UHFFFAOYSA-N
Molecular Weight 180.70
Solvent Dimethyl sulfoxide-d6; Reference=TMS; Temperature=Ambient Spectrometer= Varian CFT-20
Synonyms PROPIONIC ACID, 2-CHLOROTHIO-, S-tert-BUTYL ESTER