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2-Propanethiol

View entire compound with spectra: 12 NMR, 5 FTIR, 6 MS (GC), and 2 Near IR

2-Propanethiol
SpectraBase Compound ID b9vNwgMRPM
InChI InChI=1S/C3H8S/c1-3(2)4/h3-4H,1-2H3
InChIKey KJRCEJOSASVSRA-UHFFFAOYSA-N
Mol Weight 76.16 g/mol
Molecular Formula C3H8S
Exact Mass 76.034671 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JKR1ey7rnpo
Name ISOPROPYLMERCAPTAN
CAS Registry Number 75-33-2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C3H8S
InChI InChI=1S/C3H8S/c1-3(2)4/h3-4H,1-2H3
InChIKey KJRCEJOSASVSRA-UHFFFAOYSA-N
Literature Reference Author C.M.HALL,J.WEMPLE
Literature Reference Citation J.ORG.CHEM.,42,2118(1977)
Literature Reference DOI 10.1021/jo00432a021
Molecular Weight 76.157 g/mol
Solvent DMSO
Source File Reference UNIW13366