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2,3,4,5-TETRAHYDRO-3-METHYLTHIO-1-BENZOXEPINE;KONFORMER-(CA)

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2,3,4,5-TETRAHYDRO-3-METHYLTHIO-1-BENZOXEPINE;KONFORMER-(CA)
SpectraBase Compound ID 6FhU6DuPd8
InChI InChI=1S/C11H14OS/c1-13-10-7-6-9-4-2-3-5-11(9)12-8-10/h2-5,10H,6-8H2,1H3
InChIKey PTZOZKYWCKLLJH-UHFFFAOYSA-N
Mol Weight 194.29 g/mol
Molecular Formula C11H14OS
Exact Mass 194.076536 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2Tx4MxkVYDt
Name 2,3,4,5-TETRAHYDRO-3-METHYLTHIO-1-BENZOXEPINE;KONFORMER-(CE)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H14OS
InChI InChI=1S/C11H14OS/c1-13-10-7-6-9-4-2-3-5-11(9)12-8-10/h2-5,10H,6-8H2,1H3
InChIKey PTZOZKYWCKLLJH-UHFFFAOYSA-N
Literature Reference Author P.DIONNE,M.ST-JACQUES
Literature Reference Citation CAN.J.CHEM.,68,513(1990)
Literature Reference DOI 10.1139/v90-079
Molecular Weight 194.292 g/mol
Solvent CHClF2
Source File Reference UWED9615