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1-(gamma-chloro-p-methylcinnamylidene)hexahydro-1H-azepinium perchlorate
SpectraBase Compound ID JlKFSSjO4wN
InChI InChI=1S/C16H21ClN.ClHO4/c1-14-6-8-15(9-7-14)16(17)10-13-18-11-4-2-3-5-12-18;2-1(3,4)5/h6-10,13H,2-5,11-12H2,1H3;(H,2,3,4,5)/q+1;/p-1
InChIKey UMXYJMFXOMNIAY-UHFFFAOYSA-M
Mol Weight 362.25 g/mol
Molecular Formula C16H21Cl2NO4
Exact Mass 361.084764 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7nqBJjEOOU4
Name 1-(gamma-chloro-p-methylcinnamylidene)hexahydro-1H-azepinium perchlorate
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21Cl2NO4
InChI InChI=1S/C16H21ClN.ClHO4/c1-14-6-8-15(9-7-14)16(17)10-13-18-11-4-2-3-5-12-18;2-1(3,4)5/h6-10,13H,2-5,11-12H2,1H3;(H,2,3,4,5)/q+1;/p-1
InChIKey UMXYJMFXOMNIAY-UHFFFAOYSA-M
Instrument Name Varian CFT-20
Sadtler NMR Number 52350M
Solvent Acetonitrile-d3