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6-(3'-chlorophenyl)-1-methyl-1,2,3,4-tetrahydro-1,5-benzodiazocine

View entire compound with spectra: 1 MS (GC)

6-(3'-chlorophenyl)-1-methyl-1,2,3,4-tetrahydro-1,5-benzodiazocine
SpectraBase Compound ID KBD8KxYMsIZ
InChI InChI=1S/C17H17ClN2/c1-20-11-5-10-19-17(13-6-4-7-14(18)12-13)15-8-2-3-9-16(15)20/h2-4,6-9,12H,5,10-11H2,1H3/b19-17-
InChIKey COBOQLQTXOTTKQ-ZPHPHTNESA-N
Mol Weight 284.79 g/mol
Molecular Formula C17H17ClN2
Exact Mass 284.108026 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KdyFX7QQH3d
Name 6-(3'-chlorophenyl)-1-methyl-1,2,3,4-tetrahydro-1,5-benzodiazocine
Alternate Name(s) 6-(3-Chlorophenyl)-1-methyl-1,2,3,4-tetrahydro-1,5-benzodiazocine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17ClN2
InChI InChI=1S/C17H17ClN2/c1-20-11-5-10-19-17(13-6-4-7-14(18)12-13)15-8-2-3-9-16(15)20/h2-4,6-9,12H,5,10-11H2,1H3/b19-17-
InChIKey COBOQLQTXOTTKQ-ZPHPHTNESA-N
Molecular Weight 284.790 g/mol
SMILES c12\C(=N/CCCN(c2cccc1)C)c1cc(Cl)ccc1
SPLASH splash10-0a59-0090000000-4378df8dee3c16d72dc5
Source of Spectrum KC-1991-1979-27
Wiley ID 1288081