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2-(N-Butylthiomethylidene)-cycloheptanone

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2-(N-Butylthiomethylidene)-cycloheptanone
SpectraBase Compound ID 7sui9DQrwWy
InChI InChI=1S/C12H20OS/c1-2-3-9-14-10-11-7-5-4-6-8-12(11)13/h10H,2-9H2,1H3/b11-10+
InChIKey MQBJCPSPBXPUTO-ZHACJKMWSA-N
Mol Weight 212.35 g/mol
Molecular Formula C12H20OS
Exact Mass 212.123486 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1oIdO1pg9rh
Name 2-(N-Butylthiomethylidene)-cycloheptanone
Comments VARIAN UNITY 300 SPECTROMETER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H20OS
InChI InChI=1S/C12H20OS/c1-2-3-9-14-10-11-7-5-4-6-8-12(11)13/h10H,2-9H2,1H3/b11-10+
InChIKey MQBJCPSPBXPUTO-ZHACJKMWSA-N
Instrument Name see comment
Literature Reference A. Guerrero, A. Parrilla, F.J. Sanchez, Magn. Res. Chem. 29, 323 (1991).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3