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(E)-N-Benzyl-3-(p-toluenesulfonyl)azacyclonon-2-ene
SpectraBase Compound ID 136EZdbnVnQ
InChI InChI=1S/C22H27NO2S/c1-19-12-14-21(15-13-19)26(24,25)22-11-7-2-3-8-16-23(18-22)17-20-9-5-4-6-10-20/h4-6,9-10,12-15,18H,2-3,7-8,11,16-17H2,1H3/b22-18+
InChIKey HFRNTNCYQPMDNP-RELWKKBWSA-N
Mol Weight 369.52 g/mol
Molecular Formula C22H27NO2S
Exact Mass 369.17625 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IAgcJjoUJKm
Name (E)-N-Benzyl-3-(p-toluenesulfonyl)azacyclonon-2-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H27NO2S
InChI InChI=1S/C22H27NO2S/c1-19-12-14-21(15-13-19)26(24,25)22-11-7-2-3-8-16-23(18-22)17-20-9-5-4-6-10-20/h4-6,9-10,12-15,18H,2-3,7-8,11,16-17H2,1H3/b22-18+
InChIKey HFRNTNCYQPMDNP-RELWKKBWSA-N
Molecular Weight 369.523 g/mol
SMILES C(N1\C=C/(S(c2ccc(cc2)C)(=O)=O)CCCCCC1)c1ccccc1
SPLASH splash10-0229-0944000000-c6052bead381e0847b36
Source of Spectrum J-73-4635-23a
Wiley ID 1668251