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N-BENZYL-6-(PHENYLTHIO)-HEX-5-EN-1-AMINE;(E/Z)-MIXTURE
SpectraBase Compound ID 7KWvRon6uoU
InChI InChI=1S/2C19H23NS/c2*1(2-10-16-21-19-13-7-4-8-14-19)9-15-20-17-18-11-5-3-6-12-18/h2*3-8,10-14,16,20H,1-2,9,15,17H2/b16-10+;16-10-
InChIKey ZYXNSVSDPYRDBL-YQMGPFCXSA-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 1HGd4FGYrJj
Name N-BENZYL-6-(PHENYLTHIO)-HEX-5-EN-1-AMINE;(E/Z)-MIXTURE
Compound Number 26
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H46N2S2
InChI InChI=1S/2C19H23NS/c2*1(2-10-16-21-19-13-7-4-8-14-19)9-15-20-17-18-11-5-3-6-12-18/h2*3-8,10-14,16,20H,1-2,9,15,17H2/b16-10+;16-10-
InChIKey ZYXNSVSDPYRDBL-YQMGPFCXSA-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 UWIR20447