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4,4-Bis-(methylthio)-tricyclo-[3.2.1.0(2,7)]-octan-3-one

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4,4-Bis-(methylthio)-tricyclo-[3.2.1.0(2,7)]-octan-3-one
SpectraBase Compound ID 6JoA1oBaXYl
InChI InChI=1S/C10H14OS2/c1-12-10(13-2)5-3-6-7(4-5)8(6)9(10)11/h5-8H,3-4H2,1-2H3
InChIKey BBSJZMLURNMAFY-UHFFFAOYSA-N
Mol Weight 214.34 g/mol
Molecular Formula C10H14OS2
Exact Mass 214.048607 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GSMLpawcWMO
Name 4,4-Bis-(methylthio)-tricyclo-[3.2.1.0(2,7)]-octan-3-one
CAS Registry Number 95841-59-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H14OS2
InChI InChI=1S/C10H14OS2/c1-12-10(13-2)5-3-6-7(4-5)8(6)9(10)11/h5-8H,3-4H2,1-2H3
InChIKey BBSJZMLURNMAFY-UHFFFAOYSA-N
Instrument Name SF = 250 MHz
Literature Reference J. Org. Chem. 50, 1573 (1985).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3