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S-Benzyl phenyl-methanethiosulfonate

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S-Benzyl phenyl-methanethiosulfonate
SpectraBase Compound ID 6QKt661NDtw
InChI InChI=1S/C14H14O2S2/c15-18(16,12-14-9-5-2-6-10-14)17-11-13-7-3-1-4-8-13/h1-10H,11-12H2
InChIKey LAVBKIWRWNKSGD-UHFFFAOYSA-N
Mol Weight 278.38 g/mol
Molecular Formula C14H14O2S2
Exact Mass 278.043522 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KZO89JfQRL6
Name S-Benzyl phenyl-methanethiosulfonate
CAS Registry Number 16601-40-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H14O2S2
InChI InChI=1S/C14H14O2S2/c15-18(16,12-14-9-5-2-6-10-14)17-11-13-7-3-1-4-8-13/h1-10H,11-12H2
InChIKey LAVBKIWRWNKSGD-UHFFFAOYSA-N
Instrument Name Bruker WM-250
Literature Reference F. Freeman, C.N. Angeletakis, J. Org. Chem. 47, 4194 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3