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N-[1-METHYL-1-(5-PHENYL-1,3,4-THIAZOL-2-YL)-ETHYL]-ISOTHIOCYANAT
SpectraBase Compound ID Bus9XNsyu2h
InChI InChI=1S/C12H11N3S2/c1-12(2,13-8-16)11-15-14-10(17-11)9-6-4-3-5-7-9/h3-7H,1-2H3
InChIKey IMDIYYUAWPKMGV-UHFFFAOYSA-N
Mol Weight 261.36 g/mol
Molecular Formula C12H11N3S2
Exact Mass 261.03944 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5NZPSF0o7Kd
Name N-[1-METHYL-1-(5-PHENYL-1,3,4-THIAZOL-2-YL)-ETHYL]-ISOTHIOCYANAT
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H11N3S2
InChI InChI=1S/C12H11N3S2/c1-12(2,13-8-16)11-15-14-10(17-11)9-6-4-3-5-7-9/h3-7H,1-2H3
InChIKey IMDIYYUAWPKMGV-UHFFFAOYSA-N
Literature Reference Author M.PETIT,A.LINDEN,G.MLOSTON,H.HEIMGARTNER
Literature Reference Citation HELV.CHIM.ACTA,77,1076(1994)
Literature Reference DOI 10.1002/hlca.19940770421
Molecular Weight 261.359 g/mol
Solvent CDCl3
Source File Reference UWPR1227