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N-(4-METHYL-2-THIETANYLIDENE)-ALPHA-PHENYLETHYLAMINE;ISOMER-#A
SpectraBase Compound ID 3jTUEkrWVnG
InChI InChI=1S/C12H15NS/c1-9-8-12(14-9)13-10(2)11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3/b13-12+
InChIKey FPXOFUWBVQACIL-OUKQBFOZSA-N
Mol Weight 205.32 g/mol
Molecular Formula C12H15NS
Exact Mass 205.092521 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CMvG3DZCRVw
Name N-(4-METHYL-2-THIETANYLIDENE)-ALPHA-PHENYLETHYLAMINE;ISOMER-#B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H15NS
InChI InChI=1S/C12H15NS/c1-9-8-12(14-9)13-10(2)11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3/b13-12+
InChIKey FPXOFUWBVQACIL-OUKQBFOZSA-N
Literature Reference Author M.SAKAMOTO,T.ISHIDA,T.FUJITA,S.WATANABE
Literature Reference Citation J.ORG.CHEM.,57,2419(1992)
Literature Reference DOI 10.1021/jo00034a040
Molecular Weight 205.318 g/mol
Solvent CDCl3
Source File Reference UWCS650