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8-(4-Chlorophenyl)-5-oxo-6-phenyl-4,5,7,8-tetrahydro-3H,6H-1,2a,5a-triaza-8a-azoniaacenaphthylene Chloride
SpectraBase Compound ID 7RyjhE2t1hW
InChI InChI=1S/C20H18ClN4O.ClH/c21-16-8-6-15(7-9-16)18-12-17(14-4-2-1-3-5-14)24-19(26)10-11-23-13-22-25(18)20(23)24;/h1-9,13,17-18H,10-12H2;1H/q+1;/p-1
InChIKey DFNMZIXQAALTBC-UHFFFAOYSA-M
Mol Weight 401.3 g/mol
Molecular Formula C20H18Cl2N4O
Exact Mass 400.085767 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E74O5Bn6Fka
Name 8-(4-Chlorophenyl)-5-oxo-6-phenyl-4,5,7,8-tetrahydro-3H,6H-1,2a,5a-triaza-8a-azoniaacenaphthylene Chloride
Alternate Name(s) 8-(4-Chlorophenyl)-5-oxo-6-phenyl-3,4,5,6,7,8-hexahydro-1,2a,5a,8a-tetraazaacenaphthylen-8a-ium chloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18Cl2N4O
InChI InChI=1S/C20H18ClN4O.ClH/c21-16-8-6-15(7-9-16)18-12-17(14-4-2-1-3-5-14)24-19(26)10-11-23-13-22-25(18)20(23)24;/h1-9,13,17-18H,10-12H2;1H/q+1;/p-1
InChIKey DFNMZIXQAALTBC-UHFFFAOYSA-M
Molecular Weight 401.297 g/mol
SMILES [Cl-].c12[n+]3nc[n]1CCC(N2C(CC3c1ccc(Cl)cc1)c1ccccc1)=O
SPLASH splash10-00dr-0903000000-19211bd966318dba3776
Source of Spectrum HC-47-250-3b
Wiley ID 1733946