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N-BENZYL-5-(PHENYLTHIO)-PENT-4-EN-1-AMINE;(E/Z)-MIXTURE
SpectraBase Compound ID 2dUn0r0Gf47
InChI InChI=1S/2C18H21NS/c2*1-4-10-17(11-5-1)16-19-14-8-3-9-15-20-18-12-6-2-7-13-18/h2*1-2,4-7,9-13,15,19H,3,8,14,16H2/b15-9+;15-9-
InChIKey XLOJKEABUQNEAQ-ZCTGZOOZSA-N
Mol Weight 566.87 g/mol
Molecular Formula C36H42N2S2
Exact Mass 566.278942 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FYQF5UKhHgf
Name N-BENZYL-5-(PHENYLTHIO)-PENT-4-EN-1-AMINE;(E/Z)-MIXTURE
Compound Number 7 0
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H42N2S2
InChI InChI=1S/2C18H21NS/c2*1-4-10-17(11-5-1)16-19-14-8-3-9-15-20-18-12-6-2-7-13-18/h2*1-2,4-7,9-13,15,19H,3,8,14,16H2/b15-9+;15-9-
InChIKey XLOJKEABUQNEAQ-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 566.863 g/mol
Solvent CDCl3
Source File Reference UWIR20430