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N-BENZYL-6-(PHENYLTHIO)-HEX-5-EN-2-AMINE;(E/Z)-MIXTURE
SpectraBase Compound ID 9OXz0zripI
InChI InChI=1S/2C19H23NS/c2*1-17(20-16-18-11-4-2-5-12-18)10-8-9-15-21-19-13-6-3-7-14-19/h2*2-7,9,11-15,17,20H,8,10,16H2,1H3/b15-9+;15-9-
InChIKey HFFVIZDCPOXLDY-ZCTGZOOZSA-N
Mol Weight 594.92 g/mol
Molecular Formula C38H46N2S2
Exact Mass 594.310242 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AyO6OiJKhR7
Name N-BENZYL-6-(PHENYLTHIO)-HEX-5-EN-2-AMINE;(E/Z)-MIXTURE
Compound Number 72
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H46N2S2
InChI InChI=1S/2C19H23NS/c2*1-17(20-16-18-11-4-2-5-12-18)10-8-9-15-21-19-13-6-3-7-14-19/h2*2-7,9,11-15,17,20H,8,10,16H2,1H3/b15-9+;15-9-
InChIKey HFFVIZDCPOXLDY-ZCTGZOOZSA-N
Literature Reference Author C.QUINET,L.SAMPOUX,I.E.MARKO
Literature Reference Citation EUR.J.ORG.CHEM.,2009,1806(2009)
Literature Reference DOI 10.1002/ejoc.200900009
Molecular Weight 594.917 g/mol
Solvent CDCl3
Source File Reference UWIR20432