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2-(3-Methylsulfonyloxybutylthio)-indole
SpectraBase Compound ID 5eMO7HoYUJC
InChI InChI=1S/C13H17NO3S2/c1-10(17-19(2,15)16)7-8-18-13-9-11-5-3-4-6-12(11)14-13/h3-6,9-10,14H,7-8H2,1-2H3
InChIKey YTOHSJKETCKDNJ-UHFFFAOYSA-N
Mol Weight 299.4 g/mol
Molecular Formula C13H17NO3S2
Exact Mass 299.064986 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G5gdfuAYW3B
Name 2-(3-Methylsulfonyloxybutylthio)-indole
CAS Registry Number 129627-19-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H17NO3S2
InChI InChI=1S/C13H17NO3S2/c1-10(17-19(2,15)16)7-8-18-13-9-11-5-3-4-6-12(11)14-13/h3-6,9-10,14H,7-8H2,1-2H3
InChIKey YTOHSJKETCKDNJ-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference N. Ishizuka, J. Chem. Soc. Perkin I 813 (1990).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3